methyl 3-[[5-oxidanylidene-3-(trifluoromethyl)-1H-pyrazol-4-ylidene]methylamino]thiophene-2-carboxylate

Systemtic Name: methyl 3-[[5-oxidanylidene-3-(trifluoromethyl)-1H-pyrazol-4-ylidene]methylamino]thiophene-2-carboxylate Openeye Name: methyl 3-[[5-oxo-3-(trifluoromethyl)-1H-pyrazol-4-ylidene]methylamino]thiophene-2-carboxylate CAS Name: 3-[[5-oxo-3-(trifluoromethyl)-1H-pyrazol-4-ylidene]methylamino]-2-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 3-[[5-oxo-3-(trifluoromethyl)-1H-pyrazol-4-ylidene]methylamino]thiophene-2-carboxylate Traditional Name: 3-[[3-keto-5-(trifluoromethyl)-2-pyrazolin-4-ylidene]methylamino]thiophene-2-carboxylic acid methyl ester Formula: C11H8F3N3O3S MolecularWeight: 319.25973

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(C=CS1)NC=C2C(=NNC2=O)C(F)(F)F

Isomeric SMILES

COC(=O)C1=C(C=CS1)NC=C2C(=NNC2=O)C(F)(F)F

InChI

InChI=1S/C11H8F3N3O3S/c1-20-10(19)7-6(2-3-21-7)15-4-5-8(11(12,13)14)16-17-9(5)18/h2-4,15H,1H3,(H,17,18)