1-cyanoethyl 1-(4-fluorophenyl)-3-methyl-thieno[2,3-c]pyrazole-5-carboxylate

Systemtic Name: 1-cyanoethyl 1-(4-fluorophenyl)-3-methyl-thieno[2,3-c]pyrazole-5-carboxylate Openeye Name: 1-cyanoethyl 1-(4-fluorophenyl)-3-methyl-thieno[2,3-c]pyrazole-5-carboxylate CAS Name: 1-(4-fluorophenyl)-3-methyl-5-thieno[2,3-c]pyrazolecarboxylic acid 1-cyanoethyl ester IUPAC Name: 1-cyanoethyl 1-(4-fluorophenyl)-3-methylthieno[2,3-c]pyrazole-5-carboxylate Traditional Name: 1-(4-fluorophenyl)-3-methyl-thieno[2,3-c]pyrazole-5-carboxylic acid 1-cyanoethyl ester Formula: C16H12FN3O2S MolecularWeight: 329.348783

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H12FN3O2S/c1-9(8-18)22-16(21)14-7-13-10(2)19-20(15(13)23-14)12-5-3-11(17)4-6-12/h3-7,9H,1-2H3