N-(3-acetamido-2-methyl-phenyl)-1-[2,5-bis(fluoranyl)phenyl]sulfonyl-piperidine-4-carboxamide

Systemtic Name: N-(3-acetamido-2-methyl-phenyl)-1-[2,5-bis(fluoranyl)phenyl]sulfonyl-piperidine-4-carboxamide Openeye Name: N-(3-acetamido-2-methyl-phenyl)-1-(2,5-difluorophenyl)sulfonyl-piperidine-4-carboxamide CAS Name: N-(3-acetamido-2-methylphenyl)-1-(2,5-difluorophenyl)sulfonyl-4-piperidinecarboxamide IUPAC Name: N-(3-acetamido-2-methylphenyl)-1-(2,5-difluorophenyl)sulfonylpiperidine-4-carboxamide Traditional Name: N-(3-acetamido-2-methyl-phenyl)-1-(2,5-difluorophenyl)sulfonyl-isonipecotamide Formula: C21H23F2N3O4S MolecularWeight: 451.486826

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC=C1NC(=O)C)NC(=O)C2CCN(CC2)S(=O)(=O)C3=C(C=CC(=C3)F)F

Isomeric SMILES

CC1=C(C=CC=C1NC(=O)C)NC(=O)C2CCN(CC2)S(=O)(=O)C3=C(C=CC(=C3)F)F

InChI

InChI=1S/C21H23F2N3O4S/c1-13-18(24-14(2)27)4-3-5-19(13)25-21(28)15-8-10-26(11-9-15)31(29,30)20-12-16(22)6-7-17(20)23/h3-7,12,15H,8-11H2,1-2H3,(H,24,27)(H,25,28)