1-[2-[methyl-(4-methylphenyl)sulfonyl-amino]ethanoyl]-N-(phenylmethyl)piperidine-4-carboxamide

Systemtic Name: 1-[2-[methyl-(4-methylphenyl)sulfonyl-amino]ethanoyl]-N-(phenylmethyl)piperidine-4-carboxamide Openeye Name: N-benzyl-1-[2-[methyl(p-tolylsulfonyl)amino]acetyl]piperidine-4-carboxamide CAS Name: 1-[2-[methyl-(4-methylphenyl)sulfonylamino]-1-oxoethyl]-N-(phenylmethyl)-4-piperidinecarboxamide IUPAC Name: N-benzyl-1-[2-[methyl-(4-methylphenyl)sulfonylamino]acetyl]piperidine-4-carboxamide Traditional Name: N-benzyl-1-[2-[methyl(tosyl)amino]acetyl]isonipecotamide Formula: C23H29N3O4S MolecularWeight: 443.55906

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H29N3O4S/c1-18-8-10-21(11-9-18)31(29,30)25(2)17-22(27)26-14-12-20(13-15-26)23(28)24-16-19-6-4-3-5-7-19/h3-11,20H,12-17H2,1-2H3,(H,24,28)