[2-[(3-methoxycarbonylphenyl)amino]-2-oxidanylidene-ethyl] 2-(furan-2-yl)-4-methyl-6-methylsulfanyl-pyrimidine-5-carboxylate

Systemtic Name: [2-[(3-methoxycarbonylphenyl)amino]-2-oxidanylidene-ethyl] 2-(furan-2-yl)-4-methyl-6-methylsulfanyl-pyrimidine-5-carboxylate Openeye Name: [2-(3-methoxycarbonylanilino)-2-oxo-ethyl] 2-(2-furyl)-4-methyl-6-methylsulfanyl-pyrimidine-5-carboxylate CAS Name: 2-(2-furanyl)-4-methyl-6-(methylthio)-5-pyrimidinecarboxylic acid [2-(3-methoxycarbonylanilino)-2-oxoethyl] ester IUPAC Name: [2-(3-methoxycarbonylanilino)-2-oxoethyl] 2-(furan-2-yl)-4-methyl-6-methylsulfanylpyrimidine-5-carboxylate Traditional Name: 2-(2-furyl)-4-methyl-6-(methylthio)pyrimidine-5-carboxylic acid [2-(3-carbomethoxyanilino)-2-keto-ethyl] ester Formula: C21H19N3O6S MolecularWeight: 441.45706

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NC(=N1)C2=CC=CO2)SC)C(=O)OCC(=O)NC3=CC=CC(=C3)C(=O)OC

Isomeric SMILES

CC1=C(C(=NC(=N1)C2=CC=CO2)SC)C(=O)OCC(=O)NC3=CC=CC(=C3)C(=O)OC

InChI

InChI=1S/C21H19N3O6S/c1-12-17(19(31-3)24-18(22-12)15-8-5-9-29-15)21(27)30-11-16(25)23-14-7-4-6-13(10-14)20(26)28-2/h4-10H,11H2,1-3H3,(H,23,25)