ethyl 4-[(2-ethoxyphenyl)carbamoylamino]-2-methylsulfanyl-pyrimidine-5-carboxylate

Systemtic Name: ethyl 4-[(2-ethoxyphenyl)carbamoylamino]-2-methylsulfanyl-pyrimidine-5-carboxylate Openeye Name: ethyl 4-[(2-ethoxyphenyl)carbamoylamino]-2-methylsulfanyl-pyrimidine-5-carboxylate CAS Name: 4-[[(2-ethoxyanilino)-oxomethyl]amino]-2-(methylthio)-5-pyrimidinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[(2-ethoxyphenyl)carbamoylamino]-2-methylsulfanylpyrimidine-5-carboxylate Traditional Name: 2-(methylthio)-4-(o-phenetylcarbamoylamino)pyrimidine-5-carboxylic acid ethyl ester Formula: C17H20N4O4S MolecularWeight: 376.4301

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC=C1NC(=O)NC2=NC(=NC=C2C(=O)OCC)SC

Isomeric SMILES

CCOC1=CC=CC=C1NC(=O)NC2=NC(=NC=C2C(=O)OCC)SC

InChI

InChI=1S/C17H20N4O4S/c1-4-24-13-9-7-6-8-12(13)19-16(23)20-14-11(15(22)25-5-2)10-18-17(21-14)26-3/h6-10H,4-5H2,1-3H3,(H2,18,19,20,21,23)