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

Systemtic Name: 2-(4-ethoxyphenoxy)ethyl 1-(4-fluorophenyl)-3-methyl-thieno[2,3-c]pyrazole-5-carboxylate Openeye Name: 2-(4-ethoxyphenoxy)ethyl 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 2-(4-ethoxyphenoxy)ethyl ester IUPAC Name: 2-(4-ethoxyphenoxy)ethyl 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 2-(4-ethoxyphenoxy)ethyl ester Formula: C23H21FN2O4S MolecularWeight: 440.487243

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)OCCOC(=O)C2=CC3=C(S2)N(N=C3C)C4=CC=C(C=C4)F

Isomeric SMILES

CCOC1=CC=C(C=C1)OCCOC(=O)C2=CC3=C(S2)N(N=C3C)C4=CC=C(C=C4)F

InChI

InChI=1S/C23H21FN2O4S/c1-3-28-18-8-10-19(11-9-18)29-12-13-30-23(27)21-14-20-15(2)25-26(22(20)31-21)17-6-4-16(24)5-7-17/h4-11,14H,3,12-13H2,1-2H3