N-[3-(dimethylamino)propyl]-4-(3-fluorophenyl)sulfonyl-piperazine-1-carbothioamide

Systemtic Name: N-[3-(dimethylamino)propyl]-4-(3-fluorophenyl)sulfonyl-piperazine-1-carbothioamide Openeye Name: N-[3-(dimethylamino)propyl]-4-(3-fluorophenyl)sulfonyl-piperazine-1-carbothioamide CAS Name: N-[3-(dimethylamino)propyl]-4-(3-fluorophenyl)sulfonyl-1-piperazinecarbothioamide IUPAC Name: N-[3-(dimethylamino)propyl]-4-(3-fluorophenyl)sulfonylpiperazine-1-carbothioamide Traditional Name: N-[3-(dimethylamino)propyl]-4-(3-fluorophenyl)sulfonyl-piperazine-1-carbothioamide Formula: C16H25FN4O2S2 MolecularWeight: 388.523703

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)CCCNC(=S)N1CCN(CC1)S(=O)(=O)C2=CC=CC(=C2)F

Isomeric SMILES

CN(C)CCCNC(=S)N1CCN(CC1)S(=O)(=O)C2=CC=CC(=C2)F

InChI

InChI=1S/C16H25FN4O2S2/c1-19(2)8-4-7-18-16(24)20-9-11-21(12-10-20)25(22,23)15-6-3-5-14(17)13-15/h3,5-6,13H,4,7-12H2,1-2H3,(H,18,24)