[2-(dimethylamino)-2-oxidanylidene-ethyl] 3-methyl-1-[3-(trifluoromethyl)phenyl]thieno[2,3-c]pyrazole-5-carboxylate

Systemtic Name: [2-(dimethylamino)-2-oxidanylidene-ethyl] 3-methyl-1-[3-(trifluoromethyl)phenyl]thieno[2,3-c]pyrazole-5-carboxylate Openeye Name: [2-(dimethylamino)-2-oxo-ethyl] 3-methyl-1-[3-(trifluoromethyl)phenyl]thieno[2,3-c]pyrazole-5-carboxylate CAS Name: 3-methyl-1-[3-(trifluoromethyl)phenyl]-5-thieno[2,3-c]pyrazolecarboxylic acid [2-(dimethylamino)-2-oxoethyl] ester IUPAC Name: [2-(dimethylamino)-2-oxoethyl] 3-methyl-1-[3-(trifluoromethyl)phenyl]thieno[2,3-c]pyrazole-5-carboxylate Traditional Name: 3-methyl-1-[3-(trifluoromethyl)phenyl]thieno[2,3-c]pyrazole-5-carboxylic acid [2-(dimethylamino)-2-keto-ethyl] ester Formula: C18H16F3N3O3S MolecularWeight: 411.39815

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C2=C1C=C(S2)C(=O)OCC(=O)N(C)C)C3=CC=CC(=C3)C(F)(F)F

Isomeric SMILES

CC1=NN(C2=C1C=C(S2)C(=O)OCC(=O)N(C)C)C3=CC=CC(=C3)C(F)(F)F

InChI

InChI=1S/C18H16F3N3O3S/c1-10-13-8-14(17(26)27-9-15(25)23(2)3)28-16(13)24(22-10)12-6-4-5-11(7-12)18(19,20)21/h4-8H,9H2,1-3H3