4-[2,6-bis(fluoranyl)phenyl]sulfonyl-N-(phenylmethyl)piperazine-1-carbothioamide

Systemtic Name: 4-[2,6-bis(fluoranyl)phenyl]sulfonyl-N-(phenylmethyl)piperazine-1-carbothioamide Openeye Name: N-benzyl-4-(2,6-difluorophenyl)sulfonyl-piperazine-1-carbothioamide CAS Name: 4-(2,6-difluorophenyl)sulfonyl-N-(phenylmethyl)-1-piperazinecarbothioamide IUPAC Name: N-benzyl-4-(2,6-difluorophenyl)sulfonylpiperazine-1-carbothioamide Traditional Name: N-benzyl-4-(2,6-difluorophenyl)sulfonyl-piperazine-1-carbothioamide Formula: C18H19F2N3O2S2 MolecularWeight: 411.489166

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C(=S)NCC2=CC=CC=C2)S(=O)(=O)C3=C(C=CC=C3F)F

Isomeric SMILES

C1CN(CCN1C(=S)NCC2=CC=CC=C2)S(=O)(=O)C3=C(C=CC=C3F)F

InChI

InChI=1S/C18H19F2N3O2S2/c19-15-7-4-8-16(20)17(15)27(24,25)23-11-9-22(10-12-23)18(26)21-13-14-5-2-1-3-6-14/h1-8H,9-13H2,(H,21,26)