(3R)-N-[2-(azepan-1-yl)-2-oxidanylidene-ethyl]-1-(4-chlorophenyl)sulfonyl-piperidine-3-carboxamide

Systemtic Name: (3R)-N-[2-(azepan-1-yl)-2-oxidanylidene-ethyl]-1-(4-chlorophenyl)sulfonyl-piperidine-3-carboxamide Openeye Name: (3R)-N-[2-(azepan-1-yl)-2-oxo-ethyl]-1-(4-chlorophenyl)sulfonyl-piperidine-3-carboxamide CAS Name: (3R)-N-[2-(1-azepanyl)-2-oxoethyl]-1-(4-chlorophenyl)sulfonyl-3-piperidinecarboxamide IUPAC Name: (3R)-N-[2-(azepan-1-yl)-2-oxoethyl]-1-(4-chlorophenyl)sulfonylpiperidine-3-carboxamide Traditional Name: (3R)-N-[2-(azepan-1-yl)-2-keto-ethyl]-1-(4-chlorophenyl)sulfonyl-nipecotamide Formula: C20H28ClN3O4S MolecularWeight: 441.97202

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)C(=O)CNC(=O)C2CCCN(C2)S(=O)(=O)C3=CC=C(C=C3)Cl

Isomeric SMILES

C1CCCN(CC1)C(=O)CNC(=O)[C@@H]2CCCN(C2)S(=O)(=O)C3=CC=C(C=C3)Cl

InChI

InChI=1S/C20H28ClN3O4S/c21-17-7-9-18(10-8-17)29(27,28)24-13-5-6-16(15-24)20(26)22-14-19(25)23-11-3-1-2-4-12-23/h7-10,16H,1-6,11-15H2,(H,22,26)/t16-/m1/s1