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

Systemtic Name: N-[2,4-bis(fluoranyl)phenyl]-4-(3-bromophenyl)sulfonyl-piperazine-1-carbothioamide Openeye Name: 4-(3-bromophenyl)sulfonyl-N-(2,4-difluorophenyl)piperazine-1-carbothioamide CAS Name: 4-(3-bromophenyl)sulfonyl-N-(2,4-difluorophenyl)-1-piperazinecarbothioamide IUPAC Name: 4-(3-bromophenyl)sulfonyl-N-(2,4-difluorophenyl)piperazine-1-carbothioamide Traditional Name: 4-(3-bromophenyl)sulfonyl-N-(2,4-difluorophenyl)piperazine-1-carbothioamide Formula: C17H16BrF2N3O2S2 MolecularWeight: 476.358646

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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(=CC=C3)Br

Isomeric SMILES

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

InChI

InChI=1S/C17H16BrF2N3O2S2/c18-12-2-1-3-14(10-12)27(24,25)23-8-6-22(7-9-23)17(26)21-16-5-4-13(19)11-15(16)20/h1-5,10-11H,6-9H2,(H,21,26)