N-(3-cyano-4,5-dimethyl-thiophen-2-yl)-1-(2-cyanophenyl)sulfonyl-piperidine-4-carboxamide

Systemtic Name: N-(3-cyano-4,5-dimethyl-thiophen-2-yl)-1-(2-cyanophenyl)sulfonyl-piperidine-4-carboxamide Openeye Name: N-(3-cyano-4,5-dimethyl-2-thienyl)-1-(2-cyanophenyl)sulfonyl-piperidine-4-carboxamide CAS Name: N-(3-cyano-4,5-dimethyl-2-thiophenyl)-1-(2-cyanophenyl)sulfonyl-4-piperidinecarboxamide IUPAC Name: N-(3-cyano-4,5-dimethylthiophen-2-yl)-1-(2-cyanophenyl)sulfonylpiperidine-4-carboxamide Traditional Name: N-(3-cyano-4,5-dimethyl-2-thienyl)-1-(2-cyanophenyl)sulfonyl-isonipecotamide Formula: C20H20N4O3S2 MolecularWeight: 428.5278

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=C1C#N)NC(=O)C2CCN(CC2)S(=O)(=O)C3=CC=CC=C3C#N)C

Isomeric SMILES

CC1=C(SC(=C1C#N)NC(=O)C2CCN(CC2)S(=O)(=O)C3=CC=CC=C3C#N)C

InChI

InChI=1S/C20H20N4O3S2/c1-13-14(2)28-20(17(13)12-22)23-19(25)15-7-9-24(10-8-15)29(26,27)18-6-4-3-5-16(18)11-21/h3-6,15H,7-10H2,1-2H3,(H,23,25)