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

Systemtic Name: 1-(4-cyanophenyl)sulfonyl-N-[(4-methylphenyl)-thiophen-2-yl-methyl]piperidine-4-carboxamide Openeye Name: 1-(4-cyanophenyl)sulfonyl-N-[p-tolyl(2-thienyl)methyl]piperidine-4-carboxamide CAS Name: 1-(4-cyanophenyl)sulfonyl-N-[(4-methylphenyl)-thiophen-2-ylmethyl]-4-piperidinecarboxamide IUPAC Name: 1-(4-cyanophenyl)sulfonyl-N-[(4-methylphenyl)-thiophen-2-ylmethyl]piperidine-4-carboxamide Traditional Name: 1-(4-cyanophenyl)sulfonyl-N-[p-tolyl(2-thienyl)methyl]isonipecotamide Formula: C25H25N3O3S2 MolecularWeight: 479.6143

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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#N

Isomeric SMILES

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

InChI

InChI=1S/C25H25N3O3S2/c1-18-4-8-20(9-5-18)24(23-3-2-16-32-23)27-25(29)21-12-14-28(15-13-21)33(30,31)22-10-6-19(17-26)7-11-22/h2-11,16,21,24H,12-15H2,1H3,(H,27,29)