3-(1H-benzimidazol-2-ylsulfanyl)-N-(2,4-dimethylphenyl)propanamide

Systemtic Name: 3-(1H-benzimidazol-2-ylsulfanyl)-N-(2,4-dimethylphenyl)propanamide Openeye Name: 3-(1H-benzimidazol-2-ylsulfanyl)-N-(2,4-dimethylphenyl)propanamide CAS Name: 3-(1H-benzimidazol-2-ylthio)-N-(2,4-dimethylphenyl)propanamide IUPAC Name: 3-(1H-benzimidazol-2-ylsulfanyl)-N-(2,4-dimethylphenyl)propanamide Traditional Name: 3-(1H-benzimidazol-2-ylthio)-N-(2,4-dimethylphenyl)propionamide Formula: C18H19N3OS MolecularWeight: 325.42796

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)NC(=O)CCSC2=NC3=CC=CC=C3N2)C

Isomeric SMILES

CC1=CC(=C(C=C1)NC(=O)CCSC2=NC3=CC=CC=C3N2)C

InChI

InChI=1S/C18H19N3OS/c1-12-7-8-14(13(2)11-12)19-17(22)9-10-23-18-20-15-5-3-4-6-16(15)21-18/h3-8,11H,9-10H2,1-2H3,(H,19,22)(H,20,21)