1-(4-ethanoylphenyl)sulfonyl-N-[(4-methylphenyl)-thiophen-2-yl-methyl]piperidine-4-carboxamide

Systemtic Name: 1-(4-ethanoylphenyl)sulfonyl-N-[(4-methylphenyl)-thiophen-2-yl-methyl]piperidine-4-carboxamide Openeye Name: 1-(4-acetylphenyl)sulfonyl-N-[p-tolyl(2-thienyl)methyl]piperidine-4-carboxamide CAS Name: 1-(4-acetylphenyl)sulfonyl-N-[(4-methylphenyl)-thiophen-2-ylmethyl]-4-piperidinecarboxamide IUPAC Name: 1-(4-acetylphenyl)sulfonyl-N-[(4-methylphenyl)-thiophen-2-ylmethyl]piperidine-4-carboxamide Traditional Name: 1-(4-acetylphenyl)sulfonyl-N-[p-tolyl(2-thienyl)methyl]isonipecotamide Formula: C26H28N2O4S2 MolecularWeight: 496.64152

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(C2=CC=CS2)NC(=O)C3CCN(CC3)S(=O)(=O)C4=CC=C(C=C4)C(=O)C

Isomeric SMILES

CC1=CC=C(C=C1)C(C2=CC=CS2)NC(=O)C3CCN(CC3)S(=O)(=O)C4=CC=C(C=C4)C(=O)C

InChI

InChI=1S/C26H28N2O4S2/c1-18-5-7-21(8-6-18)25(24-4-3-17-33-24)27-26(30)22-13-15-28(16-14-22)34(31,32)23-11-9-20(10-12-23)19(2)29/h3-12,17,22,25H,13-16H2,1-2H3,(H,27,30)