methyl 2-[(2,4-diethoxyphenyl)carbonylamino]-4-pyridin-4-yl-thiophene-3-carboxylate

Systemtic Name: methyl 2-[(2,4-diethoxyphenyl)carbonylamino]-4-pyridin-4-yl-thiophene-3-carboxylate Openeye Name: methyl 2-[(2,4-diethoxybenzoyl)amino]-4-(4-pyridyl)thiophene-3-carboxylate CAS Name: 2-[[(2,4-diethoxyphenyl)-oxomethyl]amino]-4-pyridin-4-yl-3-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 2-[(2,4-diethoxybenzoyl)amino]-4-pyridin-4-ylthiophene-3-carboxylate Traditional Name: 2-[(2,4-diethoxybenzoyl)amino]-4-(4-pyridyl)thiophene-3-carboxylic acid methyl ester Formula: C22H22N2O5S MolecularWeight: 426.48548

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC(=C(C=C1)C(=O)NC2=C(C(=CS2)C3=CC=NC=C3)C(=O)OC)OCC

Isomeric SMILES

CCOC1=CC(=C(C=C1)C(=O)NC2=C(C(=CS2)C3=CC=NC=C3)C(=O)OC)OCC

InChI

InChI=1S/C22H22N2O5S/c1-4-28-15-6-7-16(18(12-15)29-5-2)20(25)24-21-19(22(26)27-3)17(13-30-21)14-8-10-23-11-9-14/h6-13H,4-5H2,1-3H3,(H,24,25)