N-(4-chloranyl-3-pyrrolidin-1-ylsulfonyl-phenyl)-1-thiophen-2-ylcarbonyl-piperidine-3-carboxamide

Systemtic Name: N-(4-chloranyl-3-pyrrolidin-1-ylsulfonyl-phenyl)-1-thiophen-2-ylcarbonyl-piperidine-3-carboxamide Openeye Name: N-(4-chloro-3-pyrrolidin-1-ylsulfonyl-phenyl)-1-(thiophene-2-carbonyl)piperidine-3-carboxamide CAS Name: N-[4-chloro-3-(1-pyrrolidinylsulfonyl)phenyl]-1-[oxo(thiophen-2-yl)methyl]-3-piperidinecarboxamide IUPAC Name: N-(4-chloro-3-pyrrolidin-1-ylsulfonylphenyl)-1-(thiophene-2-carbonyl)piperidine-3-carboxamide Traditional Name: N-(4-chloro-3-pyrrolidinosulfonyl-phenyl)-1-(2-thenoyl)nipecotamide Formula: C21H24ClN3O4S2 MolecularWeight: 482.01596

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)S(=O)(=O)C2=C(C=CC(=C2)NC(=O)C3CCCN(C3)C(=O)C4=CC=CS4)Cl

Isomeric SMILES

C1CCN(C1)S(=O)(=O)C2=C(C=CC(=C2)NC(=O)C3CCCN(C3)C(=O)C4=CC=CS4)Cl

InChI

InChI=1S/C21H24ClN3O4S2/c22-17-8-7-16(13-19(17)31(28,29)25-10-1-2-11-25)23-20(26)15-5-3-9-24(14-15)21(27)18-6-4-12-30-18/h4,6-8,12-13,15H,1-3,5,9-11,14H2,(H,23,26)