1-(3-methoxyphenyl)-4-[(4-piperidin-1-ylsulfonylphenyl)amino]cyclohexane-1-carbonitrile

Systemtic Name: 1-(3-methoxyphenyl)-4-[(4-piperidin-1-ylsulfonylphenyl)amino]cyclohexane-1-carbonitrile Openeye Name: 1-(3-methoxyphenyl)-4-[4-(1-piperidylsulfonyl)anilino]cyclohexanecarbonitrile CAS Name: 1-(3-methoxyphenyl)-4-[4-(1-piperidinylsulfonyl)anilino]-1-cyclohexanecarbonitrile IUPAC Name: 1-(3-methoxyphenyl)-4-(4-piperidin-1-ylsulfonylanilino)cyclohexane-1-carbonitrile Traditional Name: 1-(3-methoxyphenyl)-4-(4-piperidinosulfonylanilino)cyclohexanecarbonitrile Formula: C25H31N3O3S MolecularWeight: 453.59694

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)C2(CCC(CC2)NC3=CC=C(C=C3)S(=O)(=O)N4CCCCC4)C#N

Isomeric SMILES

COC1=CC=CC(=C1)C2(CCC(CC2)NC3=CC=C(C=C3)S(=O)(=O)N4CCCCC4)C#N

InChI

InChI=1S/C25H31N3O3S/c1-31-23-7-5-6-20(18-23)25(19-26)14-12-22(13-15-25)27-21-8-10-24(11-9-21)32(29,30)28-16-3-2-4-17-28/h5-11,18,22,27H,2-4,12-17H2,1H3