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

Systemtic Name: (2-methoxy-2-oxidanylidene-1-phenyl-ethyl) 1-(4-chlorophenyl)-3-methyl-thieno[2,3-c]pyrazole-5-carboxylate Openeye Name: (2-methoxy-2-oxo-1-phenyl-ethyl) 1-(4-chlorophenyl)-3-methyl-thieno[2,3-c]pyrazole-5-carboxylate CAS Name: 1-(4-chlorophenyl)-3-methyl-5-thieno[2,3-c]pyrazolecarboxylic acid (2-methoxy-2-oxo-1-phenylethyl) ester IUPAC Name: (2-methoxy-2-oxo-1-phenylethyl) 1-(4-chlorophenyl)-3-methylthieno[2,3-c]pyrazole-5-carboxylate Traditional Name: 1-(4-chlorophenyl)-3-methyl-thieno[2,3-c]pyrazole-5-carboxylic acid (2-keto-2-methoxy-1-phenyl-ethyl) ester Formula: C22H17ClN2O4S MolecularWeight: 440.89938

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C2=C1C=C(S2)C(=O)OC(C3=CC=CC=C3)C(=O)OC)C4=CC=C(C=C4)Cl

Isomeric SMILES

CC1=NN(C2=C1C=C(S2)C(=O)OC(C3=CC=CC=C3)C(=O)OC)C4=CC=C(C=C4)Cl

InChI

InChI=1S/C22H17ClN2O4S/c1-13-17-12-18(30-20(17)25(24-13)16-10-8-15(23)9-11-16)21(26)29-19(22(27)28-2)14-6-4-3-5-7-14/h3-12,19H,1-2H3