N-[2-[[cyclohexyl(methyl)amino]methyl]phenyl]-1-(4-methoxyphenyl)sulfonyl-piperidine-4-carboxamide

Systemtic Name: N-[2-[[cyclohexyl(methyl)amino]methyl]phenyl]-1-(4-methoxyphenyl)sulfonyl-piperidine-4-carboxamide Openeye Name: N-[2-[[cyclohexyl(methyl)amino]methyl]phenyl]-1-(4-methoxyphenyl)sulfonyl-piperidine-4-carboxamide CAS Name: N-[2-[[cyclohexyl(methyl)amino]methyl]phenyl]-1-(4-methoxyphenyl)sulfonyl-4-piperidinecarboxamide IUPAC Name: N-[2-[[cyclohexyl(methyl)amino]methyl]phenyl]-1-(4-methoxyphenyl)sulfonylpiperidine-4-carboxamide Traditional Name: N-[2-[[cyclohexyl(methyl)amino]methyl]phenyl]-1-(4-methoxyphenyl)sulfonyl-isonipecotamide Formula: C27H37N3O4S MolecularWeight: 499.66538

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C27H37N3O4S/c1-29(23-9-4-3-5-10-23)20-22-8-6-7-11-26(22)28-27(31)21-16-18-30(19-17-21)35(32,33)25-14-12-24(34-2)13-15-25/h6-8,11-15,21,23H,3-5,9-10,16-20H2,1-2H3,(H,28,31)