4-[(1-cyclopropyl-5-phenyl-imidazol-2-yl)sulfanylmethyl]benzenecarbonitrile

Systemtic Name: 4-[(1-cyclopropyl-5-phenyl-imidazol-2-yl)sulfanylmethyl]benzenecarbonitrile Openeye Name: 4-[(1-cyclopropyl-5-phenyl-imidazol-2-yl)sulfanylmethyl]benzonitrile CAS Name: 4-[[(1-cyclopropyl-5-phenyl-2-imidazolyl)thio]methyl]benzonitrile IUPAC Name: 4-[(1-cyclopropyl-5-phenylimidazol-2-yl)sulfanylmethyl]benzonitrile Traditional Name: 4-[[(1-cyclopropyl-5-phenyl-imidazol-2-yl)thio]methyl]benzonitrile Formula: C20H17N3S MolecularWeight: 331.43408

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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