1-[2-[(4-chlorophenyl)methyl-(4-methylphenyl)sulfonyl-amino]phenyl]carbonylpiperidine-4-carboxamide

Systemtic Name: 1-[2-[(4-chlorophenyl)methyl-(4-methylphenyl)sulfonyl-amino]phenyl]carbonylpiperidine-4-carboxamide Openeye Name: 1-[2-[(4-chlorophenyl)methyl-(p-tolylsulfonyl)amino]benzoyl]piperidine-4-carboxamide CAS Name: 1-[[2-[(4-chlorophenyl)methyl-(4-methylphenyl)sulfonylamino]phenyl]-oxomethyl]-4-piperidinecarboxamide IUPAC Name: 1-[2-[(4-chlorophenyl)methyl-(4-methylphenyl)sulfonylamino]benzoyl]piperidine-4-carboxamide Traditional Name: 1-[2-[(4-chlorobenzyl)-tosyl-amino]benzoyl]isonipecotamide Formula: C27H28ClN3O4S MolecularWeight: 526.04692

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N(CC2=CC=C(C=C2)Cl)C3=CC=CC=C3C(=O)N4CCC(CC4)C(=O)N

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N(CC2=CC=C(C=C2)Cl)C3=CC=CC=C3C(=O)N4CCC(CC4)C(=O)N

InChI

InChI=1S/C27H28ClN3O4S/c1-19-6-12-23(13-7-19)36(34,35)31(18-20-8-10-22(28)11-9-20)25-5-3-2-4-24(25)27(33)30-16-14-21(15-17-30)26(29)32/h2-13,21H,14-18H2,1H3,(H2,29,32)