N-(3-piperidin-1-ylsulfonylphenyl)-1-thiophen-2-ylcarbonyl-piperidine-3-carboxamide

Systemtic Name: N-(3-piperidin-1-ylsulfonylphenyl)-1-thiophen-2-ylcarbonyl-piperidine-3-carboxamide Openeye Name: N-[3-(1-piperidylsulfonyl)phenyl]-1-(thiophene-2-carbonyl)piperidine-3-carboxamide CAS Name: 1-[oxo(thiophen-2-yl)methyl]-N-[3-(1-piperidinylsulfonyl)phenyl]-3-piperidinecarboxamide IUPAC Name: N-(3-piperidin-1-ylsulfonylphenyl)-1-(thiophene-2-carbonyl)piperidine-3-carboxamide Traditional Name: N-(3-piperidinosulfonylphenyl)-1-(2-thenoyl)nipecotamide Formula: C22H27N3O4S2 MolecularWeight: 461.59748

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)S(=O)(=O)C2=CC=CC(=C2)NC(=O)C3CCCN(C3)C(=O)C4=CC=CS4

Isomeric SMILES

C1CCN(CC1)S(=O)(=O)C2=CC=CC(=C2)NC(=O)C3CCCN(C3)C(=O)C4=CC=CS4

InChI

InChI=1S/C22H27N3O4S2/c26-21(17-7-5-11-24(16-17)22(27)20-10-6-14-30-20)23-18-8-4-9-19(15-18)31(28,29)25-12-2-1-3-13-25/h4,6,8-10,14-15,17H,1-3,5,7,11-13,16H2,(H,23,26)