2-[4-(2-cyclohexylimino-4-methyl-pyridin-1-yl)carbonylpiperidin-1-yl]sulfonylbenzenecarbonitrile

Systemtic Name: 2-[4-(2-cyclohexylimino-4-methyl-pyridin-1-yl)carbonylpiperidin-1-yl]sulfonylbenzenecarbonitrile Openeye Name: 2-[[4-(2-cyclohexylimino-4-methyl-pyridine-1-carbonyl)-1-piperidyl]sulfonyl]benzonitrile CAS Name: 2-[[4-[(2-cyclohexylimino-4-methyl-1-pyridinyl)-oxomethyl]-1-piperidinyl]sulfonyl]benzonitrile IUPAC Name: 2-[4-(2-cyclohexylimino-4-methylpyridine-1-carbonyl)piperidin-1-yl]sulfonylbenzonitrile Traditional Name: 2-[4-(2-cyclohexylimino-4-methyl-pyridine-1-carbonyl)piperidino]sulfonylbenzonitrile Formula: C25H30N4O3S MolecularWeight: 466.5957

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC2CCCCC2)N(C=C1)C(=O)C3CCN(CC3)S(=O)(=O)C4=CC=CC=C4C#N

Isomeric SMILES

CC1=CC(=NC2CCCCC2)N(C=C1)C(=O)C3CCN(CC3)S(=O)(=O)C4=CC=CC=C4C#N

InChI

InChI=1S/C25H30N4O3S/c1-19-11-16-29(24(17-19)27-22-8-3-2-4-9-22)25(30)20-12-14-28(15-13-20)33(31,32)23-10-6-5-7-21(23)18-26/h5-7,10-11,16-17,20,22H,2-4,8-9,12-15H2,1H3