N-(4-acetamido-3-chloranyl-phenyl)-1-(4-fluorophenyl)sulfonyl-piperidine-3-carboxamide

Systemtic Name: N-(4-acetamido-3-chloranyl-phenyl)-1-(4-fluorophenyl)sulfonyl-piperidine-3-carboxamide Openeye Name: N-(4-acetamido-3-chloro-phenyl)-1-(4-fluorophenyl)sulfonyl-piperidine-3-carboxamide CAS Name: N-(4-acetamido-3-chlorophenyl)-1-(4-fluorophenyl)sulfonyl-3-piperidinecarboxamide IUPAC Name: N-(4-acetamido-3-chlorophenyl)-1-(4-fluorophenyl)sulfonylpiperidine-3-carboxamide Traditional Name: N-(4-acetamido-3-chloro-phenyl)-1-(4-fluorophenyl)sulfonyl-nipecotamide Formula: C20H21ClFN3O4S MolecularWeight: 453.914843

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=C(C=C(C=C1)NC(=O)C2CCCN(C2)S(=O)(=O)C3=CC=C(C=C3)F)Cl

Isomeric SMILES

CC(=O)NC1=C(C=C(C=C1)NC(=O)C2CCCN(C2)S(=O)(=O)C3=CC=C(C=C3)F)Cl

InChI

InChI=1S/C20H21ClFN3O4S/c1-13(26)23-19-9-6-16(11-18(19)21)24-20(27)14-3-2-10-25(12-14)30(28,29)17-7-4-15(22)5-8-17/h4-9,11,14H,2-3,10,12H2,1H3,(H,23,26)(H,24,27)