diethyl 5-[2-[3-(4-ethoxyphenyl)-6-oxidanylidene-pyridazin-1-yl]propanoylamino]-3-methyl-thiophene-2,4-dicarboxylate

Systemtic Name: diethyl 5-[2-[3-(4-ethoxyphenyl)-6-oxidanylidene-pyridazin-1-yl]propanoylamino]-3-methyl-thiophene-2,4-dicarboxylate Openeye Name: diethyl 5-[2-[3-(4-ethoxyphenyl)-6-oxo-pyridazin-1-yl]propanoylamino]-3-methyl-thiophene-2,4-dicarboxylate CAS Name: 5-[[2-[3-(4-ethoxyphenyl)-6-oxo-1-pyridazinyl]-1-oxopropyl]amino]-3-methylthiophene-2,4-dicarboxylic acid diethyl ester IUPAC Name: diethyl 5-[2-[3-(4-ethoxyphenyl)-6-oxopyridazin-1-yl]propanoylamino]-3-methylthiophene-2,4-dicarboxylate Traditional Name: 5-[2-(6-keto-3-p-phenetyl-pyridazin-1-yl)propanoylamino]-3-methyl-thiophene-2,4-dicarboxylic acid diethyl ester Formula: C26H29N3O7S MolecularWeight: 527.58936

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)C2=NN(C(=O)C=C2)C(C)C(=O)NC3=C(C(=C(S3)C(=O)OCC)C)C(=O)OCC

Isomeric SMILES

CCOC1=CC=C(C=C1)C2=NN(C(=O)C=C2)C(C)C(=O)NC3=C(C(=C(S3)C(=O)OCC)C)C(=O)OCC

InChI

InChI=1S/C26H29N3O7S/c1-6-34-18-11-9-17(10-12-18)19-13-14-20(30)29(28-19)16(5)23(31)27-24-21(25(32)35-7-2)15(4)22(37-24)26(33)36-8-3/h9-14,16H,6-8H2,1-5H3,(H,27,31)