1-(2-chlorophenyl)carbonyl-N-(4-pyrrolidin-1-ylsulfonylphenyl)piperidine-4-carboxamide

Systemtic Name: 1-(2-chlorophenyl)carbonyl-N-(4-pyrrolidin-1-ylsulfonylphenyl)piperidine-4-carboxamide Openeye Name: 1-(2-chlorobenzoyl)-N-(4-pyrrolidin-1-ylsulfonylphenyl)piperidine-4-carboxamide CAS Name: 1-[(2-chlorophenyl)-oxomethyl]-N-[4-(1-pyrrolidinylsulfonyl)phenyl]-4-piperidinecarboxamide IUPAC Name: 1-(2-chlorobenzoyl)-N-(4-pyrrolidin-1-ylsulfonylphenyl)piperidine-4-carboxamide Traditional Name: 1-(2-chlorobenzoyl)-N-(4-pyrrolidinosulfonylphenyl)isonipecotamide Formula: C23H26ClN3O4S MolecularWeight: 475.98824

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)S(=O)(=O)C2=CC=C(C=C2)NC(=O)C3CCN(CC3)C(=O)C4=CC=CC=C4Cl

Isomeric SMILES

C1CCN(C1)S(=O)(=O)C2=CC=C(C=C2)NC(=O)C3CCN(CC3)C(=O)C4=CC=CC=C4Cl

InChI

InChI=1S/C23H26ClN3O4S/c24-21-6-2-1-5-20(21)23(29)26-15-11-17(12-16-26)22(28)25-18-7-9-19(10-8-18)32(30,31)27-13-3-4-14-27/h1-2,5-10,17H,3-4,11-16H2,(H,25,28)