[7-(ethoxycarbonylamino)-2-oxidanylidene-chromen-4-yl]methyl 2-methylsulfanylpyridine-3-carboxylate

Systemtic Name: [7-(ethoxycarbonylamino)-2-oxidanylidene-chromen-4-yl]methyl 2-methylsulfanylpyridine-3-carboxylate Openeye Name: [7-(ethoxycarbonylamino)-2-oxo-chromen-4-yl]methyl 2-methylsulfanylpyridine-3-carboxylate CAS Name: 2-(methylthio)-3-pyridinecarboxylic acid [7-(ethoxycarbonylamino)-2-oxo-1-benzopyran-4-yl]methyl ester IUPAC Name: [7-(ethoxycarbonylamino)-2-oxochromen-4-yl]methyl 2-methylsulfanylpyridine-3-carboxylate Traditional Name: 2-(methylthio)nicotinic acid [7-(carbethoxyamino)-2-keto-chromen-4-yl]methyl ester Formula: C20H18N2O6S MolecularWeight: 414.43172

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)NC1=CC2=C(C=C1)C(=CC(=O)O2)COC(=O)C3=C(N=CC=C3)SC

Isomeric SMILES

CCOC(=O)NC1=CC2=C(C=C1)C(=CC(=O)O2)COC(=O)C3=C(N=CC=C3)SC

InChI

InChI=1S/C20H18N2O6S/c1-3-26-20(25)22-13-6-7-14-12(9-17(23)28-16(14)10-13)11-27-19(24)15-5-4-8-21-18(15)29-2/h4-10H,3,11H2,1-2H3,(H,22,25)