(2R)-N-(3-cyanophenyl)-2-[1-(2-methylpropyl)benzimidazol-2-yl]sulfanyl-propanamide

Systemtic Name: (2R)-N-(3-cyanophenyl)-2-[1-(2-methylpropyl)benzimidazol-2-yl]sulfanyl-propanamide Openeye Name: (2R)-N-(3-cyanophenyl)-2-(1-isobutylbenzimidazol-2-yl)sulfanyl-propanamide CAS Name: (2R)-N-(3-cyanophenyl)-2-[[1-(2-methylpropyl)-2-benzimidazolyl]thio]propanamide IUPAC Name: (2R)-N-(3-cyanophenyl)-2-[1-(2-methylpropyl)benzimidazol-2-yl]sulfanylpropanamide Traditional Name: (2R)-N-(3-cyanophenyl)-2-[(1-isobutylbenzimidazol-2-yl)thio]propionamide Formula: C21H22N4OS MolecularWeight: 378.49058

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CN1C2=CC=CC=C2N=C1SC(C)C(=O)NC3=CC=CC(=C3)C#N

Isomeric SMILES

C[C@H](C(=O)NC1=CC=CC(=C1)C#N)SC2=NC3=CC=CC=C3N2CC(C)C

InChI

InChI=1S/C21H22N4OS/c1-14(2)13-25-19-10-5-4-9-18(19)24-21(25)27-15(3)20(26)23-17-8-6-7-16(11-17)12-22/h4-11,14-15H,13H2,1-3H3,(H,23,26)/t15-/m1/s1