4-pyrimidin-2-yl-N-[3-(trifluoromethyl)phenyl]piperazine-1-carbothioamide

Systemtic Name: 4-pyrimidin-2-yl-N-[3-(trifluoromethyl)phenyl]piperazine-1-carbothioamide Openeye Name: 4-pyrimidin-2-yl-N-[3-(trifluoromethyl)phenyl]piperazine-1-carbothioamide CAS Name: 4-(2-pyrimidinyl)-N-[3-(trifluoromethyl)phenyl]-1-piperazinecarbothioamide IUPAC Name: 4-pyrimidin-2-yl-N-[3-(trifluoromethyl)phenyl]piperazine-1-carbothioamide Traditional Name: 4-(2-pyrimidyl)-N-[3-(trifluoromethyl)phenyl]piperazine-1-carbothioamide Formula: C16H16F3N5S MolecularWeight: 367.39195

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=NC=CC=N2)C(=S)NC3=CC=CC(=C3)C(F)(F)F

Isomeric SMILES

C1CN(CCN1C2=NC=CC=N2)C(=S)NC3=CC=CC(=C3)C(F)(F)F

InChI

InChI=1S/C16H16F3N5S/c17-16(18,19)12-3-1-4-13(11-12)22-15(25)24-9-7-23(8-10-24)14-20-5-2-6-21-14/h1-6,11H,7-10H2,(H,22,25)