(3S)-1-(4-acetamidophenyl)sulfonyl-N-[(3-chlorophenyl)methyl]piperidine-3-carboxamide

Systemtic Name: (3S)-1-(4-acetamidophenyl)sulfonyl-N-[(3-chlorophenyl)methyl]piperidine-3-carboxamide Openeye Name: (3S)-1-(4-acetamidophenyl)sulfonyl-N-[(3-chlorophenyl)methyl]piperidine-3-carboxamide CAS Name: (3S)-1-(4-acetamidophenyl)sulfonyl-N-[(3-chlorophenyl)methyl]-3-piperidinecarboxamide IUPAC Name: (3S)-1-(4-acetamidophenyl)sulfonyl-N-[(3-chlorophenyl)methyl]piperidine-3-carboxamide Traditional Name: (3S)-1-(4-acetamidophenyl)sulfonyl-N-(3-chlorobenzyl)nipecotamide Formula: C21H24ClN3O4S MolecularWeight: 449.95096

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC=C(C=C1)S(=O)(=O)N2CCCC(C2)C(=O)NCC3=CC(=CC=C3)Cl

Isomeric SMILES

CC(=O)NC1=CC=C(C=C1)S(=O)(=O)N2CCC[C@@H](C2)C(=O)NCC3=CC(=CC=C3)Cl

InChI

InChI=1S/C21H24ClN3O4S/c1-15(26)24-19-7-9-20(10-8-19)30(28,29)25-11-3-5-17(14-25)21(27)23-13-16-4-2-6-18(22)12-16/h2,4,6-10,12,17H,3,5,11,13-14H2,1H3,(H,23,27)(H,24,26)/t17-/m0/s1