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

Systemtic Name: N-[1-[2-(4-methoxyphenyl)ethylamino]-1-oxidanylidene-propan-2-yl]-1-(4-methylphenyl)sulfonyl-piperidine-4-carboxamide Openeye Name: N-[2-[2-(4-methoxyphenyl)ethylamino]-1-methyl-2-oxo-ethyl]-1-(p-tolylsulfonyl)piperidine-4-carboxamide CAS Name: N-[1-[2-(4-methoxyphenyl)ethylamino]-1-oxopropan-2-yl]-1-(4-methylphenyl)sulfonyl-4-piperidinecarboxamide IUPAC Name: N-[1-[2-(4-methoxyphenyl)ethylamino]-1-oxopropan-2-yl]-1-(4-methylphenyl)sulfonylpiperidine-4-carboxamide Traditional Name: N-[2-keto-2-[2-(4-methoxyphenyl)ethylamino]-1-methyl-ethyl]-1-tosyl-isonipecotamide Formula: C25H33N3O5S MolecularWeight: 487.61162

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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)NCCC3=CC=C(C=C3)OC

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2CCC(CC2)C(=O)NC(C)C(=O)NCCC3=CC=C(C=C3)OC

InChI

InChI=1S/C25H33N3O5S/c1-18-4-10-23(11-5-18)34(31,32)28-16-13-21(14-17-28)25(30)27-19(2)24(29)26-15-12-20-6-8-22(33-3)9-7-20/h4-11,19,21H,12-17H2,1-3H3,(H,26,29)(H,27,30)