N-(2,3-dimethyl-5-sulfamoyl-phenyl)-1-(4-fluorophenyl)carbonyl-piperidine-3-carboxamide

Systemtic Name: N-(2,3-dimethyl-5-sulfamoyl-phenyl)-1-(4-fluorophenyl)carbonyl-piperidine-3-carboxamide Openeye Name: N-(2,3-dimethyl-5-sulfamoyl-phenyl)-1-(4-fluorobenzoyl)piperidine-3-carboxamide CAS Name: N-(2,3-dimethyl-5-sulfamoylphenyl)-1-[(4-fluorophenyl)-oxomethyl]-3-piperidinecarboxamide IUPAC Name: N-(2,3-dimethyl-5-sulfamoylphenyl)-1-(4-fluorobenzoyl)piperidine-3-carboxamide Traditional Name: N-(2,3-dimethyl-5-sulfamoyl-phenyl)-1-(4-fluorobenzoyl)nipecotamide Formula: C21H24FN3O4S MolecularWeight: 433.496363

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1C)NC(=O)C2CCCN(C2)C(=O)C3=CC=C(C=C3)F)S(=O)(=O)N

Isomeric SMILES

CC1=CC(=CC(=C1C)NC(=O)C2CCCN(C2)C(=O)C3=CC=C(C=C3)F)S(=O)(=O)N

InChI

InChI=1S/C21H24FN3O4S/c1-13-10-18(30(23,28)29)11-19(14(13)2)24-20(26)16-4-3-9-25(12-16)21(27)15-5-7-17(22)8-6-15/h5-8,10-11,16H,3-4,9,12H2,1-2H3,(H,24,26)(H2,23,28,29)