2-(1-cyclohexylpiperidin-4-yl)-2-[4-(4-methoxyphenyl)sulfinylphenyl]propanenitrile

Systemtic Name: 2-(1-cyclohexylpiperidin-4-yl)-2-[4-(4-methoxyphenyl)sulfinylphenyl]propanenitrile Openeye Name: 2-(1-cyclohexyl-4-piperidyl)-2-[4-(4-methoxyphenyl)sulfinylphenyl]propanenitrile CAS Name: 2-(1-cyclohexyl-4-piperidinyl)-2-[4-(4-methoxyphenyl)sulfinylphenyl]propanenitrile IUPAC Name: 2-(1-cyclohexylpiperidin-4-yl)-2-[4-(4-methoxyphenyl)sulfinylphenyl]propanenitrile Traditional Name: 2-(1-cyclohexyl-4-piperidyl)-2-[4-(4-methoxyphenyl)sulfinylphenyl]propionitrile Formula: C27H34N2O2S MolecularWeight: 450.63606

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Descriptors Computed from Structure

Canonical SMILES:

CC(C#N)(C1CCN(CC1)C2CCCCC2)C3=CC=C(C=C3)S(=O)C4=CC=C(C=C4)OC

Isomeric SMILES

CC(C#N)(C1CCN(CC1)C2CCCCC2)C3=CC=C(C=C3)S(=O)C4=CC=C(C=C4)OC

InChI

InChI=1S/C27H34N2O2S/c1-27(20-28,22-16-18-29(19-17-22)23-6-4-3-5-7-23)21-8-12-25(13-9-21)32(30)26-14-10-24(31-2)11-15-26/h8-15,22-23H,3-7,16-19H2,1-2H3