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

Systemtic Name: N-(3-cyano-4,5-dimethyl-thiophen-2-yl)-1-(4-methoxyphenyl)sulfonyl-piperidine-4-carboxamide Openeye Name: N-(3-cyano-4,5-dimethyl-2-thienyl)-1-(4-methoxyphenyl)sulfonyl-piperidine-4-carboxamide CAS Name: N-(3-cyano-4,5-dimethyl-2-thiophenyl)-1-(4-methoxyphenyl)sulfonyl-4-piperidinecarboxamide IUPAC Name: N-(3-cyano-4,5-dimethylthiophen-2-yl)-1-(4-methoxyphenyl)sulfonylpiperidine-4-carboxamide Traditional Name: N-(3-cyano-4,5-dimethyl-2-thienyl)-1-(4-methoxyphenyl)sulfonyl-isonipecotamide Formula: C20H23N3O4S2 MolecularWeight: 433.54432

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H23N3O4S2/c1-13-14(2)28-20(18(13)12-21)22-19(24)15-8-10-23(11-9-15)29(25,26)17-6-4-16(27-3)5-7-17/h4-7,15H,8-11H2,1-3H3,(H,22,24)