Marvin  02050910292D          

 26 29  0  0  0  0            999 V2000
    0.0000    0.1990    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.5724   -0.2135    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.5724   -0.2135    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.6586   -1.0340    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    4.3260    0.1220    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8579    0.1990    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.8579    0.1990    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7145   -0.2135    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    0.7145   -0.2135    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -4.3260    0.1220    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    3.6586   -1.0340    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000    1.0240    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.1434   -0.2135    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1434   -0.2135    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.4289    0.1990    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4289    0.1990    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.8781   -0.4911    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -2.8579    1.0240    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.8579    1.0240    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.4656   -1.2055    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.8781   -0.4911    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1434    1.4365    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.1434    1.4365    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.4289    1.0240    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4289    1.0240    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  8  1  1  0  0  0  0
  9  1  1  0  0  0  0
 12  1  2  0  0  0  0
  6  2  1  0  0  0  0
  4  2  1  0  0  0  0
 10  2  2  0  0  0  0
  7  3  1  0  0  0  0
  5  3  2  0  0  0  0
 11  3  1  0  0  0  0
 18  4  1  0  0  0  0
 17  5  1  0  0  0  0
 14  6  2  0  0  0  0
 19  6  1  0  0  0  0
 13  7  2  0  0  0  0
 20  7  1  0  0  0  0
 16  8  1  0  0  0  0
 15  9  1  0  0  0  0
 22 10  1  0  0  0  0
 21 11  1  0  0  0  0
 15 13  1  0  0  0  0
 16 14  1  0  0  0  0
 25 15  2  0  0  0  0
 26 16  2  0  0  0  0
 21 17  1  0  0  0  0
 22 18  1  0  0  0  0
 23 19  2  0  0  0  0
 24 20  2  0  0  0  0
 26 23  1  0  0  0  0
 25 24  1  0  0  0  0
M  END
> <ID>
CHEBI:51804

> <NAME>
imidocarb

> <STAR>
3

> <SYNONYM>
N,N'-bis(3-(4,5-dihydro-1H-imidazol-2-yl)phenyl)urea; 1,3-bis(3-(2-imidazolin-2-yl)phenyl)urea; 1,3-Bis(3-(2-imidazolin-2-yl)phenyl)harnstoff

> <IUPAC_NAME>
1,3-bis[3-(4,5-dihydro-1H-imidazol-2-yl)phenyl]urea

> <INN>
imidocarbum; imidocarbo; imidocarbe; imidocarb

> <FORMULA>
C19H20N6O

> <MASS>
348.40194

> <MONOISOTOPIC_MASS>
348.16986

> <CHARGE>
0

> <SMILES>
O=C(Nc1cccc(c1)C1=NCCN1)Nc1cccc(c1)C1=NCCN1

> <INCHI>
InChI=1S/C19H20N6O/c26-19(24-15-5-1-3-13(11-15)17-20-7-8-21-17)25-16-6-2-4-14(12-16)18-22-9-10-23-18/h1-6,11-12H,7-10H2,(H,20,21)(H,22,23)(H2,24,25,26)

> <INCHIKEY>
SCEVFJUWLLRELN-UHFFFAOYSA-N

> <BEILSTEIN_REGISTRY_NUMBER>
964732

> <CAS_REGISTRY_NUMBER>
27885-92-3

> <CHEMIDPLUS>
27885-92-3

$$$$