4-[[2-[4-(2-oxidanylidene-3H-benzimidazol-1-yl)piperidin-1-yl]carbonylphenyl]sulfanylmethyl]benzenecarbonitrile

Systemtic Name: 4-[[2-[4-(2-oxidanylidene-3H-benzimidazol-1-yl)piperidin-1-yl]carbonylphenyl]sulfanylmethyl]benzenecarbonitrile Openeye Name: 4-[[2-[4-(2-oxo-3H-benzimidazol-1-yl)piperidine-1-carbonyl]phenyl]sulfanylmethyl]benzonitrile CAS Name: 4-[[[2-[oxo-[4-(2-oxo-3H-benzimidazol-1-yl)-1-piperidinyl]methyl]phenyl]thio]methyl]benzonitrile IUPAC Name: 4-[[2-[4-(2-oxo-3H-benzimidazol-1-yl)piperidine-1-carbonyl]phenyl]sulfanylmethyl]benzonitrile Traditional Name: 4-[[[2-[4-(2-keto-3H-benzimidazol-1-yl)piperidine-1-carbonyl]phenyl]thio]methyl]benzonitrile Formula: C27H24N4O2S MolecularWeight: 468.57006

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1N2C3=CC=CC=C3NC2=O)C(=O)C4=CC=CC=C4SCC5=CC=C(C=C5)C#N

Isomeric SMILES

C1CN(CCC1N2C3=CC=CC=C3NC2=O)C(=O)C4=CC=CC=C4SCC5=CC=C(C=C5)C#N

InChI

InChI=1S/C27H24N4O2S/c28-17-19-9-11-20(12-10-19)18-34-25-8-4-1-5-22(25)26(32)30-15-13-21(14-16-30)31-24-7-3-2-6-23(24)29-27(31)33/h1-12,21H,13-16,18H2,(H,29,33)