N-propyl-4-[5-(trifluoromethyl)pyridin-2-yl]piperazine-1-carbothioamide

Systemtic Name: N-propyl-4-[5-(trifluoromethyl)pyridin-2-yl]piperazine-1-carbothioamide Openeye Name: N-propyl-4-[5-(trifluoromethyl)-2-pyridyl]piperazine-1-carbothioamide CAS Name: N-propyl-4-[5-(trifluoromethyl)-2-pyridinyl]-1-piperazinecarbothioamide IUPAC Name: N-propyl-4-[5-(trifluoromethyl)pyridin-2-yl]piperazine-1-carbothioamide Traditional Name: N-propyl-4-[5-(trifluoromethyl)-2-pyridyl]piperazine-1-carbothioamide Formula: C14H19F3N4S MolecularWeight: 332.38767

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Descriptors Computed from Structure

Canonical SMILES:

CCCNC(=S)N1CCN(CC1)C2=NC=C(C=C2)C(F)(F)F

Isomeric SMILES

CCCNC(=S)N1CCN(CC1)C2=NC=C(C=C2)C(F)(F)F

InChI

InChI=1S/C14H19F3N4S/c1-2-5-18-13(22)21-8-6-20(7-9-21)12-4-3-11(10-19-12)14(15,16)17/h3-4,10H,2,5-9H2,1H3,(H,18,22)