N-(2,5-dimethylphenyl)-2-[2-(phenylmethylsulfanyl)benzimidazol-1-yl]propanamide

Systemtic Name: N-(2,5-dimethylphenyl)-2-[2-(phenylmethylsulfanyl)benzimidazol-1-yl]propanamide Openeye Name: 2-(2-benzylsulfanylbenzimidazol-1-yl)-N-(2,5-dimethylphenyl)propanamide CAS Name: N-(2,5-dimethylphenyl)-2-[2-(phenylmethylthio)-1-benzimidazolyl]propanamide IUPAC Name: 2-(2-benzylsulfanylbenzimidazol-1-yl)-N-(2,5-dimethylphenyl)propanamide Traditional Name: 2-[2-(benzylthio)benzimidazol-1-yl]-N-(2,5-dimethylphenyl)propionamide Formula: C25H25N3OS MolecularWeight: 415.5505

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)NC(=O)C(C)N2C3=CC=CC=C3N=C2SCC4=CC=CC=C4

Isomeric SMILES

CC1=CC(=C(C=C1)C)NC(=O)C(C)N2C3=CC=CC=C3N=C2SCC4=CC=CC=C4

InChI

InChI=1S/C25H25N3OS/c1-17-13-14-18(2)22(15-17)26-24(29)19(3)28-23-12-8-7-11-21(23)27-25(28)30-16-20-9-5-4-6-10-20/h4-15,19H,16H2,1-3H3,(H,26,29)