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

Systemtic Name: (2R)-2-[1-(2-methoxyethyl)benzimidazol-2-yl]sulfanyl-3-(4-methylphenyl)propanenitrile Openeye Name: (2R)-2-[1-(2-methoxyethyl)benzimidazol-2-yl]sulfanyl-3-(p-tolyl)propanenitrile CAS Name: (2R)-2-[[1-(2-methoxyethyl)-2-benzimidazolyl]thio]-3-(4-methylphenyl)propanenitrile IUPAC Name: (2R)-2-[1-(2-methoxyethyl)benzimidazol-2-yl]sulfanyl-3-(4-methylphenyl)propanenitrile Traditional Name: (2R)-2-[[1-(2-methoxyethyl)benzimidazol-2-yl]thio]-3-(p-tolyl)propionitrile Formula: C20H21N3OS MolecularWeight: 351.46524

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CC(C#N)SC2=NC3=CC=CC=C3N2CCOC

Isomeric SMILES

CC1=CC=C(C=C1)C[C@H](C#N)SC2=NC3=CC=CC=C3N2CCOC

InChI

InChI=1S/C20H21N3OS/c1-15-7-9-16(10-8-15)13-17(14-21)25-20-22-18-5-3-4-6-19(18)23(20)11-12-24-2/h3-10,17H,11-13H2,1-2H3/t17-/m1/s1