(2-methoxycarbonylphenyl) 3-methyl-1-phenyl-thieno[2,3-c]pyrazole-5-carboxylate

Systemtic Name: (2-methoxycarbonylphenyl) 3-methyl-1-phenyl-thieno[2,3-c]pyrazole-5-carboxylate Openeye Name: (2-methoxycarbonylphenyl) 3-methyl-1-phenyl-thieno[2,3-c]pyrazole-5-carboxylate CAS Name: 3-methyl-1-phenyl-5-thieno[2,3-c]pyrazolecarboxylic acid (2-methoxycarbonylphenyl) ester IUPAC Name: (2-methoxycarbonylphenyl) 3-methyl-1-phenylthieno[2,3-c]pyrazole-5-carboxylate Traditional Name: 3-methyl-1-phenyl-thieno[2,3-c]pyrazole-5-carboxylic acid (2-carbomethoxyphenyl) ester Formula: C21H16N2O4S MolecularWeight: 392.42774

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C2=C1C=C(S2)C(=O)OC3=CC=CC=C3C(=O)OC)C4=CC=CC=C4

Isomeric SMILES

CC1=NN(C2=C1C=C(S2)C(=O)OC3=CC=CC=C3C(=O)OC)C4=CC=CC=C4

InChI

InChI=1S/C21H16N2O4S/c1-13-16-12-18(28-19(16)23(22-13)14-8-4-3-5-9-14)21(25)27-17-11-7-6-10-15(17)20(24)26-2/h3-12H,1-2H3