ethyl 2-(furan-2-yl)-4-methyl-6-[2-oxidanylidene-2-(propylcarbamoylamino)ethyl]sulfanyl-pyrimidine-5-carboxylate

Systemtic Name: ethyl 2-(furan-2-yl)-4-methyl-6-[2-oxidanylidene-2-(propylcarbamoylamino)ethyl]sulfanyl-pyrimidine-5-carboxylate Openeye Name: ethyl 2-(2-furyl)-4-methyl-6-[2-oxo-2-(propylcarbamoylamino)ethyl]sulfanyl-pyrimidine-5-carboxylate CAS Name: 2-(2-furanyl)-4-methyl-6-[[2-oxo-2-[[oxo(propylamino)methyl]amino]ethyl]thio]-5-pyrimidinecarboxylic acid ethyl ester IUPAC Name: ethyl 2-(furan-2-yl)-4-methyl-6-[2-oxo-2-(propylcarbamoylamino)ethyl]sulfanylpyrimidine-5-carboxylate Traditional Name: 2-(2-furyl)-4-[[2-keto-2-(propylcarbamoylamino)ethyl]thio]-6-methyl-pyrimidine-5-carboxylic acid ethyl ester Formula: C18H22N4O5S MolecularWeight: 406.45608

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Descriptors Computed from Structure

Canonical SMILES:

CCCNC(=O)NC(=O)CSC1=NC(=NC(=C1C(=O)OCC)C)C2=CC=CO2

Isomeric SMILES

CCCNC(=O)NC(=O)CSC1=NC(=NC(=C1C(=O)OCC)C)C2=CC=CO2

InChI

InChI=1S/C18H22N4O5S/c1-4-8-19-18(25)21-13(23)10-28-16-14(17(24)26-5-2)11(3)20-15(22-16)12-7-6-9-27-12/h6-7,9H,4-5,8,10H2,1-3H3,(H2,19,21,23,25)