methyl 5-(4-methoxyphenyl)-1-(6-thiophen-2-ylpyridazin-3-yl)pyrazole-3-carboxylate

Systemtic Name: methyl 5-(4-methoxyphenyl)-1-(6-thiophen-2-ylpyridazin-3-yl)pyrazole-3-carboxylate Openeye Name: methyl 5-(4-methoxyphenyl)-1-[6-(2-thienyl)pyridazin-3-yl]pyrazole-3-carboxylate CAS Name: 5-(4-methoxyphenyl)-1-(6-thiophen-2-yl-3-pyridazinyl)-3-pyrazolecarboxylic acid methyl ester IUPAC Name: methyl 5-(4-methoxyphenyl)-1-(6-thiophen-2-ylpyridazin-3-yl)pyrazole-3-carboxylate Traditional Name: 5-(4-methoxyphenyl)-1-[6-(2-thienyl)pyridazin-3-yl]pyrazole-3-carboxylic acid methyl ester Formula: C20H16N4O3S MolecularWeight: 392.43104

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2=CC(=NN2C3=NN=C(C=C3)C4=CC=CS4)C(=O)OC

Isomeric SMILES

COC1=CC=C(C=C1)C2=CC(=NN2C3=NN=C(C=C3)C4=CC=CS4)C(=O)OC

InChI

InChI=1S/C20H16N4O3S/c1-26-14-7-5-13(6-8-14)17-12-16(20(25)27-2)23-24(17)19-10-9-15(21-22-19)18-4-3-11-28-18/h3-12H,1-2H3