CHEBI:133645 - (S)-triarimol

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name (S)-triarimol
ChEBI ID CHEBI:133645
ChEBI ASCII Name (S)-triarimol
Definition A (2,4-dichlorophenyl)(phenyl)pyrimidin-5-ylmethanol that has S configuration.
Stars This entity has been manually annotated by the ChEBI Team.
Supplier Information
Download Molfile XML SDF
Formula C17H12Cl2N2O
Net Charge 0
Average Mass 331.196
Monoisotopic Mass 330.03267
InChI InChI=1S/C17H12Cl2N2O/c18-14-6-7-15(16(19)8-14)17(22,12-4-2-1-3-5-12)13-9-20-11-21-10-13/h1-11,22H/t17-/m0/s1
InChIKey MYUPFXPCYUISAG-KRWDZBQOSA-N
SMILES [C@@](C1=CN=CN=C1)(O)(C=2C=CC=CC2)C=3C=CC(=CC3Cl)Cl
ChEBI Ontology
Outgoing (S)-triarimol (CHEBI:133645) is a (2,4-dichlorophenyl)(phenyl)pyrimidin-5-ylmethanol (CHEBI:133643)
(S)-triarimol (CHEBI:133645) is enantiomer of (R)-triarimol (CHEBI:133644)
Incoming triarimol (CHEBI:82074) has part (S)-triarimol (CHEBI:133645)
(R)-triarimol (CHEBI:133644) is enantiomer of (S)-triarimol (CHEBI:133645)
IUPAC Name
(S)-(2,4-dichlorophenyl)(phenyl)pyrimidin-5-ylmethanol
Last Modified
05 October 2016