3-[(1-cyclopropyl-5-phenyl-imidazol-2-yl)sulfanylmethyl]benzenecarbonitrile

Systemtic Name: 3-[(1-cyclopropyl-5-phenyl-imidazol-2-yl)sulfanylmethyl]benzenecarbonitrile Openeye Name: 3-[(1-cyclopropyl-5-phenyl-imidazol-2-yl)sulfanylmethyl]benzonitrile CAS Name: 3-[[(1-cyclopropyl-5-phenyl-2-imidazolyl)thio]methyl]benzonitrile IUPAC Name: 3-[(1-cyclopropyl-5-phenylimidazol-2-yl)sulfanylmethyl]benzonitrile Traditional Name: 3-[[(1-cyclopropyl-5-phenyl-imidazol-2-yl)thio]methyl]benzonitrile Formula: C20H17N3S MolecularWeight: 331.43408

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC1N2C(=CN=C2SCC3=CC=CC(=C3)C#N)C4=CC=CC=C4

Isomeric SMILES

C1CC1N2C(=CN=C2SCC3=CC=CC(=C3)C#N)C4=CC=CC=C4

InChI

InChI=1S/C20H17N3S/c21-12-15-5-4-6-16(11-15)14-24-20-22-13-19(23(20)18-9-10-18)17-7-2-1-3-8-17/h1-8,11,13,18H,9-10,14H2