N-[2,4-bis(fluoranyl)phenyl]-4-(4-methylphenyl)sulfonyl-piperazine-1-carboxamide

Systemtic Name: N-[2,4-bis(fluoranyl)phenyl]-4-(4-methylphenyl)sulfonyl-piperazine-1-carboxamide Openeye Name: N-(2,4-difluorophenyl)-4-(p-tolylsulfonyl)piperazine-1-carboxamide CAS Name: N-(2,4-difluorophenyl)-4-(4-methylphenyl)sulfonyl-1-piperazinecarboxamide IUPAC Name: N-(2,4-difluorophenyl)-4-(4-methylphenyl)sulfonylpiperazine-1-carboxamide Traditional Name: N-(2,4-difluorophenyl)-4-tosyl-piperazine-1-carboxamide Formula: C18H19F2N3O3S MolecularWeight: 395.423566

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)C(=O)NC3=C(C=C(C=C3)F)F

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)C(=O)NC3=C(C=C(C=C3)F)F

InChI

InChI=1S/C18H19F2N3O3S/c1-13-2-5-15(6-3-13)27(25,26)23-10-8-22(9-11-23)18(24)21-17-7-4-14(19)12-16(17)20/h2-7,12H,8-11H2,1H3,(H,21,24)