1-[2,4-bis(fluoranyl)phenyl]-2-methyl-N-[(4-methylphenyl)methyl]-4-methylsulfonyl-6-oxidanylidene-piperazine-2-carboxamide

Systemtic Name: 1-[2,4-bis(fluoranyl)phenyl]-2-methyl-N-[(4-methylphenyl)methyl]-4-methylsulfonyl-6-oxidanylidene-piperazine-2-carboxamide Openeye Name: 1-(2,4-difluorophenyl)-2-methyl-4-methylsulfonyl-6-oxo-N-(p-tolylmethyl)piperazine-2-carboxamide CAS Name: 1-(2,4-difluorophenyl)-2-methyl-N-[(4-methylphenyl)methyl]-4-methylsulfonyl-6-oxo-2-piperazinecarboxamide IUPAC Name: 1-(2,4-difluorophenyl)-2-methyl-N-[(4-methylphenyl)methyl]-4-methylsulfonyl-6-oxopiperazine-2-carboxamide Traditional Name: 1-(2,4-difluorophenyl)-6-keto-4-mesyl-2-methyl-N-(4-methylbenzyl)piperazine-2-carboxamide Formula: C21H23F2N3O4S MolecularWeight: 451.486826

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CNC(=O)C2(CN(CC(=O)N2C3=C(C=C(C=C3)F)F)S(=O)(=O)C)C

Isomeric SMILES

CC1=CC=C(C=C1)CNC(=O)C2(CN(CC(=O)N2C3=C(C=C(C=C3)F)F)S(=O)(=O)C)C

InChI

InChI=1S/C21H23F2N3O4S/c1-14-4-6-15(7-5-14)11-24-20(28)21(2)13-25(31(3,29)30)12-19(27)26(21)18-9-8-16(22)10-17(18)23/h4-10H,11-13H2,1-3H3,(H,24,28)