4-[2,4-bis(fluoranyl)phenyl]sulfonyl-N-(3-methylphenyl)piperazine-1-carbothioamide

Systemtic Name: 4-[2,4-bis(fluoranyl)phenyl]sulfonyl-N-(3-methylphenyl)piperazine-1-carbothioamide Openeye Name: 4-(2,4-difluorophenyl)sulfonyl-N-(m-tolyl)piperazine-1-carbothioamide CAS Name: 4-(2,4-difluorophenyl)sulfonyl-N-(3-methylphenyl)-1-piperazinecarbothioamide IUPAC Name: 4-(2,4-difluorophenyl)sulfonyl-N-(3-methylphenyl)piperazine-1-carbothioamide Traditional Name: 4-(2,4-difluorophenyl)sulfonyl-N-(m-tolyl)piperazine-1-carbothioamide Formula: C18H19F2N3O2S2 MolecularWeight: 411.489166

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H19F2N3O2S2/c1-13-3-2-4-15(11-13)21-18(26)22-7-9-23(10-8-22)27(24,25)17-6-5-14(19)12-16(17)20/h2-6,11-12H,7-10H2,1H3,(H,21,26)