1-(5-phenyl-3,4-dihydropyrazol-2-yl)-2-[4-(trifluoromethyl)pyrimidin-2-yl]sulfanyl-ethanone

Systemtic Name: 1-(5-phenyl-3,4-dihydropyrazol-2-yl)-2-[4-(trifluoromethyl)pyrimidin-2-yl]sulfanyl-ethanone Openeye Name: 1-(5-phenyl-3,4-dihydropyrazol-2-yl)-2-[4-(trifluoromethyl)pyrimidin-2-yl]sulfanyl-ethanone CAS Name: 1-(5-phenyl-3,4-dihydropyrazol-2-yl)-2-[[4-(trifluoromethyl)-2-pyrimidinyl]thio]ethanone IUPAC Name: 1-(5-phenyl-3,4-dihydropyrazol-2-yl)-2-[4-(trifluoromethyl)pyrimidin-2-yl]sulfanylethanone Traditional Name: 1-(3-phenyl-2-pyrazolin-1-yl)-2-[[4-(trifluoromethyl)pyrimidin-2-yl]thio]ethanone Formula: C16H13F3N4OS MolecularWeight: 366.36083

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(N=C1C2=CC=CC=C2)C(=O)CSC3=NC=CC(=N3)C(F)(F)F

Isomeric SMILES

C1CN(N=C1C2=CC=CC=C2)C(=O)CSC3=NC=CC(=N3)C(F)(F)F

InChI

InChI=1S/C16H13F3N4OS/c17-16(18,19)13-6-8-20-15(21-13)25-10-14(24)23-9-7-12(22-23)11-4-2-1-3-5-11/h1-6,8H,7,9-10H2