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

Systemtic Name: N-[2,4-bis(fluoranyl)phenyl]-4-(4-fluorophenyl)sulfonyl-piperazine-1-carbothioamide Openeye Name: N-(2,4-difluorophenyl)-4-(4-fluorophenyl)sulfonyl-piperazine-1-carbothioamide CAS Name: N-(2,4-difluorophenyl)-4-(4-fluorophenyl)sulfonyl-1-piperazinecarbothioamide IUPAC Name: N-(2,4-difluorophenyl)-4-(4-fluorophenyl)sulfonylpiperazine-1-carbothioamide Traditional Name: N-(2,4-difluorophenyl)-4-(4-fluorophenyl)sulfonyl-piperazine-1-carbothioamide Formula: C17H16F3N3O2S2 MolecularWeight: 415.45305

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C(=S)NC2=C(C=C(C=C2)F)F)S(=O)(=O)C3=CC=C(C=C3)F

Isomeric SMILES

C1CN(CCN1C(=S)NC2=C(C=C(C=C2)F)F)S(=O)(=O)C3=CC=C(C=C3)F

InChI

InChI=1S/C17H16F3N3O2S2/c18-12-1-4-14(5-2-12)27(24,25)23-9-7-22(8-10-23)17(26)21-16-6-3-13(19)11-15(16)20/h1-6,11H,7-10H2,(H,21,26)