N-[1-[(4-chlorophenyl)methylamino]-1-oxidanylidene-propan-2-yl]-1-(4-methylphenyl)sulfonyl-piperidine-4-carboxamide

Systemtic Name: N-[1-[(4-chlorophenyl)methylamino]-1-oxidanylidene-propan-2-yl]-1-(4-methylphenyl)sulfonyl-piperidine-4-carboxamide Openeye Name: N-[2-[(4-chlorophenyl)methylamino]-1-methyl-2-oxo-ethyl]-1-(p-tolylsulfonyl)piperidine-4-carboxamide CAS Name: N-[1-[(4-chlorophenyl)methylamino]-1-oxopropan-2-yl]-1-(4-methylphenyl)sulfonyl-4-piperidinecarboxamide IUPAC Name: N-[1-[(4-chlorophenyl)methylamino]-1-oxopropan-2-yl]-1-(4-methylphenyl)sulfonylpiperidine-4-carboxamide Traditional Name: N-[2-[(4-chlorobenzyl)amino]-2-keto-1-methyl-ethyl]-1-tosyl-isonipecotamide Formula: C23H28ClN3O4S MolecularWeight: 478.00412

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2CCC(CC2)C(=O)NC(C)C(=O)NCC3=CC=C(C=C3)Cl

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2CCC(CC2)C(=O)NC(C)C(=O)NCC3=CC=C(C=C3)Cl

InChI

InChI=1S/C23H28ClN3O4S/c1-16-3-9-21(10-4-16)32(30,31)27-13-11-19(12-14-27)23(29)26-17(2)22(28)25-15-18-5-7-20(24)8-6-18/h3-10,17,19H,11-15H2,1-2H3,(H,25,28)(H,26,29)