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4-methylsulfonyl-2-[5-prop-2-ynoxy-3-(trifluoromethyl)pyrazol-1-yl]pyrimidine

4-methylsulfonyl-2-[5-prop-2-ynoxy-3-(trifluoromethyl)pyrazol-1-yl]pyrimidine

Systemtic Name:4-methylsulfonyl-2-[5-prop-2-ynoxy-3-(trifluoromethyl)pyrazol-1-yl]pyrimidine
Openeye Name:4-methylsulfonyl-2-[5-prop-2-ynoxy-3-(trifluoromethyl)pyrazol-1-yl]pyrimidine
CAS Name:4-methylsulfonyl-2-[5-prop-2-ynoxy-3-(trifluoromethyl)-1-pyrazolyl]pyrimidine
IUPAC Name:4-methylsulfonyl-2-[5-prop-2-ynoxy-3-(trifluoromethyl)pyrazol-1-yl]pyrimidine
Traditional Name:4-mesyl-2-[5-propargyloxy-3-(trifluoromethyl)pyrazol-1-yl]pyrimidine
Formula: C12H9F3N4O3S
MolecularWeight: 346.28507
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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=NC(=NC=C1)N2C(=CC(=N2)C(F)(F)F)OCC#C


Isomeric SMILES

CS(=O)(=O)C1=NC(=NC=C1)N2C(=CC(=N2)C(F)(F)F)OCC#C


InChI

InChI=1S/C12H9F3N4O3S/c1-3-6-22-10-7-8(12(13,14)15)18-19(10)11-16-5-4-9(17-11)23(2,20)21/h1,4-5,7H,6H2,2H3


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