3-(1-phenethylbenzimidazol-2-yl)sulfanylpropanenitrile

Systemtic Name: 3-(1-phenethylbenzimidazol-2-yl)sulfanylpropanenitrile Openeye Name: 3-(1-phenethylbenzimidazol-2-yl)sulfanylpropanenitrile CAS Name: 3-[(1-phenethyl-2-benzimidazolyl)thio]propanenitrile IUPAC Name: 3-(1-phenethylbenzimidazol-2-yl)sulfanylpropanenitrile Traditional Name: 3-[(1-phenethylbenzimidazol-2-yl)thio]propionitrile Formula: C18H17N3S MolecularWeight: 307.41268

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCN2C3=CC=CC=C3N=C2SCCC#N

Isomeric SMILES

C1=CC=C(C=C1)CCN2C3=CC=CC=C3N=C2SCCC#N

InChI

InChI=1S/C18H17N3S/c19-12-6-14-22-18-20-16-9-4-5-10-17(16)21(18)13-11-15-7-2-1-3-8-15/h1-5,7-10H,6,11,13-14H2