N-butyl-4-(2-fluorophenyl)sulfonyl-piperazine-1-carbothioamide

Systemtic Name: N-butyl-4-(2-fluorophenyl)sulfonyl-piperazine-1-carbothioamide Openeye Name: N-butyl-4-(2-fluorophenyl)sulfonyl-piperazine-1-carbothioamide CAS Name: N-butyl-4-(2-fluorophenyl)sulfonyl-1-piperazinecarbothioamide IUPAC Name: N-butyl-4-(2-fluorophenyl)sulfonylpiperazine-1-carbothioamide Traditional Name: N-butyl-4-(2-fluorophenyl)sulfonyl-piperazine-1-carbothioamide Formula: C15H22FN3O2S2 MolecularWeight: 359.482483

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=S)N1CCN(CC1)S(=O)(=O)C2=CC=CC=C2F

Isomeric SMILES

CCCCNC(=S)N1CCN(CC1)S(=O)(=O)C2=CC=CC=C2F

InChI

InChI=1S/C15H22FN3O2S2/c1-2-3-8-17-15(22)18-9-11-19(12-10-18)23(20,21)14-7-5-4-6-13(14)16/h4-7H,2-3,8-12H2,1H3,(H,17,22)