2-(4-methylpiperazin-1-yl)-5-(trifluoromethyl)benzenecarbothioamide

Systemtic Name: 2-(4-methylpiperazin-1-yl)-5-(trifluoromethyl)benzenecarbothioamide Openeye Name: 2-(4-methylpiperazin-1-yl)-5-(trifluoromethyl)benzenecarbothioamide CAS Name: 2-(4-methyl-1-piperazinyl)-5-(trifluoromethyl)benzenecarbothioamide IUPAC Name: 2-(4-methylpiperazin-1-yl)-5-(trifluoromethyl)benzenecarbothioamide Traditional Name: 2-(4-methylpiperazino)-5-(trifluoromethyl)thiobenzamide Formula: C13H16F3N3S MolecularWeight: 303.34645

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)C2=C(C=C(C=C2)C(F)(F)F)C(=S)N

Isomeric SMILES

CN1CCN(CC1)C2=C(C=C(C=C2)C(F)(F)F)C(=S)N

InChI

InChI=1S/C13H16F3N3S/c1-18-4-6-19(7-5-18)11-3-2-9(13(14,15)16)8-10(11)12(17)20/h2-3,8H,4-7H2,1H3,(H2,17,20)