(2R)-2-[1-(2-cyanoethyl)benzimidazol-2-yl]sulfanyl-3-(4-methylphenyl)propanenitrile

Systemtic Name: (2R)-2-[1-(2-cyanoethyl)benzimidazol-2-yl]sulfanyl-3-(4-methylphenyl)propanenitrile Openeye Name: (2R)-2-[1-(2-cyanoethyl)benzimidazol-2-yl]sulfanyl-3-(p-tolyl)propanenitrile CAS Name: (2R)-2-[[1-(2-cyanoethyl)-2-benzimidazolyl]thio]-3-(4-methylphenyl)propanenitrile IUPAC Name: (2R)-2-[1-(2-cyanoethyl)benzimidazol-2-yl]sulfanyl-3-(4-methylphenyl)propanenitrile Traditional Name: (2R)-2-[[1-(2-cyanoethyl)benzimidazol-2-yl]thio]-3-(p-tolyl)propionitrile Formula: C20H18N4S MolecularWeight: 346.44872

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CC(C#N)SC2=NC3=CC=CC=C3N2CCC#N

Isomeric SMILES

CC1=CC=C(C=C1)C[C@H](C#N)SC2=NC3=CC=CC=C3N2CCC#N

InChI

InChI=1S/C20H18N4S/c1-15-7-9-16(10-8-15)13-17(14-22)25-20-23-18-5-2-3-6-19(18)24(20)12-4-11-21/h2-3,5-10,17H,4,12-13H2,1H3/t17-/m1/s1