2-[2-(6-methoxy-6-methylsulfanyl-cyclohexa-2,4-dien-1-yl)-3H-benzimidazol-5-yl]-2-methyl-propanenitrile

Systemtic Name: 2-[2-(6-methoxy-6-methylsulfanyl-cyclohexa-2,4-dien-1-yl)-3H-benzimidazol-5-yl]-2-methyl-propanenitrile Openeye Name: 2-[2-(6-methoxy-6-methylsulfanyl-cyclohexa-2,4-dien-1-yl)-3H-benzimidazol-5-yl]-2-methyl-propanenitrile CAS Name: 2-[2-[6-methoxy-6-(methylthio)-1-cyclohexa-2,4-dienyl]-3H-benzimidazol-5-yl]-2-methylpropanenitrile IUPAC Name: 2-[2-(6-methoxy-6-methylsulfanylcyclohexa-2,4-dien-1-yl)-3H-benzimidazol-5-yl]-2-methylpropanenitrile Traditional Name: 2-[2-[6-methoxy-6-(methylthio)cyclohexa-2,4-dien-1-yl]-3H-benzimidazol-5-yl]-2-methyl-propionitrile Formula: C19H21N3OS MolecularWeight: 339.45454

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C#N)C1=CC2=C(C=C1)N=C(N2)C3C=CC=CC3(OC)SC

Isomeric SMILES

CC(C)(C#N)C1=CC2=C(C=C1)N=C(N2)C3C=CC=CC3(OC)SC

InChI

InChI=1S/C19H21N3OS/c1-18(2,12-20)13-8-9-15-16(11-13)22-17(21-15)14-7-5-6-10-19(14,23-3)24-4/h5-11,14H,1-4H3,(H,21,22)