(2R)-N-(cyclopropylcarbamoyl)-2-[1-(4-methylphenyl)benzimidazol-2-yl]sulfanyl-propanamide

Systemtic Name: (2R)-N-(cyclopropylcarbamoyl)-2-[1-(4-methylphenyl)benzimidazol-2-yl]sulfanyl-propanamide Openeye Name: (2R)-N-(cyclopropylcarbamoyl)-2-[1-(p-tolyl)benzimidazol-2-yl]sulfanyl-propanamide CAS Name: (2R)-N-[(cyclopropylamino)-oxomethyl]-2-[[1-(4-methylphenyl)-2-benzimidazolyl]thio]propanamide IUPAC Name: (2R)-N-(cyclopropylcarbamoyl)-2-[1-(4-methylphenyl)benzimidazol-2-yl]sulfanylpropanamide Traditional Name: (2R)-N-(cyclopropylcarbamoyl)-2-[[1-(p-tolyl)benzimidazol-2-yl]thio]propionamide Formula: C21H22N4O2S MolecularWeight: 394.48998

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N2C3=CC=CC=C3N=C2SC(C)C(=O)NC(=O)NC4CC4

Isomeric SMILES

CC1=CC=C(C=C1)N2C3=CC=CC=C3N=C2S[C@H](C)C(=O)NC(=O)NC4CC4

InChI

InChI=1S/C21H22N4O2S/c1-13-7-11-16(12-8-13)25-18-6-4-3-5-17(18)23-21(25)28-14(2)19(26)24-20(27)22-15-9-10-15/h3-8,11-12,14-15H,9-10H2,1-2H3,(H2,22,24,26,27)/t14-/m1/s1