N-(1,3-dimethyl-2-oxidanylidene-benzimidazol-5-yl)-3-(phenylmethylsulfanyl)propanamide

Systemtic Name: N-(1,3-dimethyl-2-oxidanylidene-benzimidazol-5-yl)-3-(phenylmethylsulfanyl)propanamide Openeye Name: 3-benzylsulfanyl-N-(1,3-dimethyl-2-oxo-benzimidazol-5-yl)propanamide CAS Name: N-(1,3-dimethyl-2-oxo-5-benzimidazolyl)-3-(phenylmethylthio)propanamide IUPAC Name: 3-benzylsulfanyl-N-(1,3-dimethyl-2-oxobenzimidazol-5-yl)propanamide Traditional Name: 3-(benzylthio)-N-(2-keto-1,3-dimethyl-benzimidazol-5-yl)propionamide Formula: C19H21N3O2S MolecularWeight: 355.45394

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C=C(C=C2)NC(=O)CCSCC3=CC=CC=C3)N(C1=O)C

Isomeric SMILES

CN1C2=C(C=C(C=C2)NC(=O)CCSCC3=CC=CC=C3)N(C1=O)C

InChI

InChI=1S/C19H21N3O2S/c1-21-16-9-8-15(12-17(16)22(2)19(21)24)20-18(23)10-11-25-13-14-6-4-3-5-7-14/h3-9,12H,10-11,13H2,1-2H3,(H,20,23)