CHEBI:105217 - 7-methyl-2-[4-(4-methylphenyl)sulfonyl-1,4-diazepan-1-yl]-3-quinolinecarbonitrile

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ChEBI Name 7-methyl-2-[4-(4-methylphenyl)sulfonyl-1,4-diazepan-1-yl]-3-quinolinecarbonitrile
ChEBI ID CHEBI:105217
Stars This entity has been manually annotated by a third party.
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Formula C23H24N4O2S
Net Charge 0
Average Mass 420.529
Monoisotopic Mass 420.16200
InChI InChI=1S/C23H24N4O2S/c1-17-5-8-21(9-6-17)30(28,29)27-11-3-10-26(12-13-27)23-20(16-24)15-19-7-4-18(2)14-22(19)25-23/h4-9,14-15H,3,10-13H2,1-2H3
InChIKey ADZSGAYQELWUNZ-UHFFFAOYSA-N
SMILES CC1=CC=C(C=C1)S(=O)(=O)N2CCCN(CC2)C3=NC4=C(C=CC(=C4)C)C=C3C#N
ChEBI Ontology
Outgoing 7-methyl-2-[4-(4-methylphenyl)sulfonyl-1,4-diazepan-1-yl]-3-quinolinecarbonitrile (CHEBI:105217) is a sulfonamide (CHEBI:35358)
Manual Xref Database
LSM-16580 LINCS
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