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

Systemtic Name: 2-(4-ethoxyphenoxy)ethyl 1-(3-chlorophenyl)-3-methyl-thieno[2,3-c]pyrazole-5-carboxylate Openeye Name: 2-(4-ethoxyphenoxy)ethyl 1-(3-chlorophenyl)-3-methyl-thieno[2,3-c]pyrazole-5-carboxylate CAS Name: 1-(3-chlorophenyl)-3-methyl-5-thieno[2,3-c]pyrazolecarboxylic acid 2-(4-ethoxyphenoxy)ethyl ester IUPAC Name: 2-(4-ethoxyphenoxy)ethyl 1-(3-chlorophenyl)-3-methylthieno[2,3-c]pyrazole-5-carboxylate Traditional Name: 1-(3-chlorophenyl)-3-methyl-thieno[2,3-c]pyrazole-5-carboxylic acid 2-(4-ethoxyphenoxy)ethyl ester Formula: C23H21ClN2O4S MolecularWeight: 456.94184

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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(=CC=C4)Cl

Isomeric SMILES

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

InChI

InChI=1S/C23H21ClN2O4S/c1-3-28-18-7-9-19(10-8-18)29-11-12-30-23(27)21-14-20-15(2)25-26(22(20)31-21)17-6-4-5-16(24)13-17/h4-10,13-14H,3,11-12H2,1-2H3