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

Systemtic Name: [2-[(4-acetamidophenyl)amino]-2-oxidanylidene-ethyl] 1-(4-chlorophenyl)-3-methyl-thieno[2,3-c]pyrazole-5-carboxylate Openeye Name: [2-(4-acetamidoanilino)-2-oxo-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-(4-acetamidoanilino)-2-oxoethyl] ester IUPAC Name: [2-(4-acetamidoanilino)-2-oxoethyl] 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-(4-acetamidoanilino)-2-keto-ethyl] ester Formula: C23H19ClN4O4S MolecularWeight: 482.93936

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C2=C1C=C(S2)C(=O)OCC(=O)NC3=CC=C(C=C3)NC(=O)C)C4=CC=C(C=C4)Cl

Isomeric SMILES

CC1=NN(C2=C1C=C(S2)C(=O)OCC(=O)NC3=CC=C(C=C3)NC(=O)C)C4=CC=C(C=C4)Cl

InChI

InChI=1S/C23H19ClN4O4S/c1-13-19-11-20(33-22(19)28(27-13)18-9-3-15(24)4-10-18)23(31)32-12-21(30)26-17-7-5-16(6-8-17)25-14(2)29/h3-11H,12H2,1-2H3,(H,25,29)(H,26,30)