N-[3-(methylcarbamoyl)phenyl]-1-thiophen-2-ylsulfonyl-piperidine-4-carboxamide

Systemtic Name: N-[3-(methylcarbamoyl)phenyl]-1-thiophen-2-ylsulfonyl-piperidine-4-carboxamide Openeye Name: N-[3-(methylcarbamoyl)phenyl]-1-(2-thienylsulfonyl)piperidine-4-carboxamide CAS Name: N-[3-(methylcarbamoyl)phenyl]-1-thiophen-2-ylsulfonyl-4-piperidinecarboxamide IUPAC Name: N-[3-(methylcarbamoyl)phenyl]-1-thiophen-2-ylsulfonylpiperidine-4-carboxamide Traditional Name: N-[3-(methylcarbamoyl)phenyl]-1-(2-thienylsulfonyl)isonipecotamide Formula: C18H21N3O4S2 MolecularWeight: 407.50704

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Descriptors Computed from Structure

Canonical SMILES:

CNC(=O)C1=CC(=CC=C1)NC(=O)C2CCN(CC2)S(=O)(=O)C3=CC=CS3

Isomeric SMILES

CNC(=O)C1=CC(=CC=C1)NC(=O)C2CCN(CC2)S(=O)(=O)C3=CC=CS3

InChI

InChI=1S/C18H21N3O4S2/c1-19-17(22)14-4-2-5-15(12-14)20-18(23)13-7-9-21(10-8-13)27(24,25)16-6-3-11-26-16/h2-6,11-13H,7-10H2,1H3,(H,19,22)(H,20,23)