2-[(3-ethoxy-2-ethoxycarbonyl-3-oxidanylidene-prop-1-enyl)amino]-5-pyridin-4-yl-thiophene-3-carboxylic acid

Systemtic Name: 2-[(3-ethoxy-2-ethoxycarbonyl-3-oxidanylidene-prop-1-enyl)amino]-5-pyridin-4-yl-thiophene-3-carboxylic acid Openeye Name: 2-[(3-ethoxy-2-ethoxycarbonyl-3-oxo-prop-1-enyl)amino]-5-(4-pyridyl)thiophene-3-carboxylic acid CAS Name: 2-[(3-ethoxy-2-ethoxycarbonyl-3-oxoprop-1-enyl)amino]-5-pyridin-4-yl-3-thiophenecarboxylic acid IUPAC Name: 2-[(3-ethoxy-2-ethoxycarbonyl-3-oxoprop-1-enyl)amino]-5-pyridin-4-ylthiophene-3-carboxylic acid Traditional Name: 2-[(2-carbethoxy-3-ethoxy-3-keto-prop-1-enyl)amino]-5-(4-pyridyl)-3-thenoic acid Formula: C18H18N2O6S MolecularWeight: 390.41032

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(=CNC1=C(C=C(S1)C2=CC=NC=C2)C(=O)O)C(=O)OCC

Isomeric SMILES

CCOC(=O)C(=CNC1=C(C=C(S1)C2=CC=NC=C2)C(=O)O)C(=O)OCC

InChI

InChI=1S/C18H18N2O6S/c1-3-25-17(23)13(18(24)26-4-2)10-20-15-12(16(21)22)9-14(27-15)11-5-7-19-8-6-11/h5-10,20H,3-4H2,1-2H3,(H,21,22)