4-[4-(1-cyclohexyl-1,2,3,4-tetrazol-5-yl)-4-phenylazanyl-piperidin-1-yl]-2,2-diphenyl-butanenitrile

Systemtic Name: 4-[4-(1-cyclohexyl-1,2,3,4-tetrazol-5-yl)-4-phenylazanyl-piperidin-1-yl]-2,2-diphenyl-butanenitrile Openeye Name: 4-[4-anilino-4-(1-cyclohexyltetrazol-5-yl)-1-piperidyl]-2,2-diphenyl-butanenitrile CAS Name: 4-[4-anilino-4-(1-cyclohexyl-5-tetrazolyl)-1-piperidinyl]-2,2-diphenylbutanenitrile IUPAC Name: 4-[4-anilino-4-(1-cyclohexyltetrazol-5-yl)piperidin-1-yl]-2,2-diphenylbutanenitrile Traditional Name: 4-[4-anilino-4-(1-cyclohexyltetrazol-5-yl)piperidino]-2,2-diphenyl-butyronitrile Formula: C34H39N7 MolecularWeight: 545.72036

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)N2C(=NN=N2)C3(CCN(CC3)CCC(C#N)(C4=CC=CC=C4)C5=CC=CC=C5)NC6=CC=CC=C6

Isomeric SMILES

C1CCC(CC1)N2C(=NN=N2)C3(CCN(CC3)CCC(C#N)(C4=CC=CC=C4)C5=CC=CC=C5)NC6=CC=CC=C6

InChI

InChI=1S/C34H39N7/c35-27-33(28-13-5-1-6-14-28,29-15-7-2-8-16-29)21-24-40-25-22-34(23-26-40,36-30-17-9-3-10-18-30)32-37-38-39-41(32)31-19-11-4-12-20-31/h1-3,5-10,13-18,31,36H,4,11-12,19-26H2