2-(4-cyclohexylpiperazin-1-yl)-2-(4-cyclohexylsulfanylphenyl)ethanenitrile

Systemtic Name: 2-(4-cyclohexylpiperazin-1-yl)-2-(4-cyclohexylsulfanylphenyl)ethanenitrile Openeye Name: 2-(4-cyclohexylpiperazin-1-yl)-2-(4-cyclohexylsulfanylphenyl)acetonitrile CAS Name: 2-(4-cyclohexyl-1-piperazinyl)-2-[4-(cyclohexylthio)phenyl]acetonitrile IUPAC Name: 2-(4-cyclohexylpiperazin-1-yl)-2-(4-cyclohexylsulfanylphenyl)acetonitrile Traditional Name: 2-(4-cyclohexylpiperazino)-2-[4-(cyclohexylthio)phenyl]acetonitrile Formula: C24H35N3S MolecularWeight: 397.6198

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)N2CCN(CC2)C(C#N)C3=CC=C(C=C3)SC4CCCCC4

Isomeric SMILES

C1CCC(CC1)N2CCN(CC2)C(C#N)C3=CC=C(C=C3)SC4CCCCC4

InChI

InChI=1S/C24H35N3S/c25-19-24(27-17-15-26(16-18-27)21-7-3-1-4-8-21)20-11-13-23(14-12-20)28-22-9-5-2-6-10-22/h11-14,21-22,24H,1-10,15-18H2