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methyl 5-sulfanylidene-7-(trifluoromethyl)-1H-pyrazolo[1,5-a]pyrimidine-3-carboxylate

methyl 5-sulfanylidene-7-(trifluoromethyl)-1H-pyrazolo[1,5-a]pyrimidine-3-carboxylate

Systemtic Name:methyl 5-sulfanylidene-7-(trifluoromethyl)-1H-pyrazolo[1,5-a]pyrimidine-3-carboxylate
Openeye Name:methyl 5-thioxo-7-(trifluoromethyl)-1H-pyrazolo[1,5-a]pyrimidine-3-carboxylate
CAS Name:5-sulfanylidene-7-(trifluoromethyl)-1H-pyrazolo[1,5-a]pyrimidine-3-carboxylic acid methyl ester
IUPAC Name:methyl 5-sulfanylidene-7-(trifluoromethyl)-1H-pyrazolo[1,5-a]pyrimidine-3-carboxylate
Traditional Name:5-thioxo-7-(trifluoromethyl)-1H-pyrazolo[1,5-a]pyrimidine-3-carboxylic acid methyl ester
Formula: C9H6F3N3O2S
MolecularWeight: 277.22305
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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CNN2C1=NC(=S)C=C2C(F)(F)F


Isomeric SMILES

COC(=O)C1=CNN2C1=NC(=S)C=C2C(F)(F)F


InChI

InChI=1S/C9H6F3N3O2S/c1-17-8(16)4-3-13-15-5(9(10,11)12)2-6(18)14-7(4)15/h2-3,13H,1H3


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