N-[2-[[cyclohexyl(methyl)amino]methyl]phenyl]-1-pyridin-3-ylsulfonyl-piperidine-4-carboxamide

Systemtic Name: N-[2-[[cyclohexyl(methyl)amino]methyl]phenyl]-1-pyridin-3-ylsulfonyl-piperidine-4-carboxamide Openeye Name: N-[2-[[cyclohexyl(methyl)amino]methyl]phenyl]-1-(3-pyridylsulfonyl)piperidine-4-carboxamide CAS Name: N-[2-[[cyclohexyl(methyl)amino]methyl]phenyl]-1-(3-pyridinylsulfonyl)-4-piperidinecarboxamide IUPAC Name: N-[2-[[cyclohexyl(methyl)amino]methyl]phenyl]-1-pyridin-3-ylsulfonylpiperidine-4-carboxamide Traditional Name: N-[2-[[cyclohexyl(methyl)amino]methyl]phenyl]-1-(3-pyridylsulfonyl)isonipecotamide Formula: C25H34N4O3S MolecularWeight: 470.62746

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=CC=CC=C1NC(=O)C2CCN(CC2)S(=O)(=O)C3=CN=CC=C3)C4CCCCC4

Isomeric SMILES

CN(CC1=CC=CC=C1NC(=O)C2CCN(CC2)S(=O)(=O)C3=CN=CC=C3)C4CCCCC4

InChI

InChI=1S/C25H34N4O3S/c1-28(22-9-3-2-4-10-22)19-21-8-5-6-12-24(21)27-25(30)20-13-16-29(17-14-20)33(31,32)23-11-7-15-26-18-23/h5-8,11-12,15,18,20,22H,2-4,9-10,13-14,16-17,19H2,1H3,(H,27,30)