ethyl 2-methylsulfanyl-4-[(3,4,5-trimethoxyphenyl)carbamoylamino]pyrimidine-5-carboxylate

Systemtic Name: ethyl 2-methylsulfanyl-4-[(3,4,5-trimethoxyphenyl)carbamoylamino]pyrimidine-5-carboxylate Openeye Name: ethyl 2-methylsulfanyl-4-[(3,4,5-trimethoxyphenyl)carbamoylamino]pyrimidine-5-carboxylate CAS Name: 2-(methylthio)-4-[[oxo-(3,4,5-trimethoxyanilino)methyl]amino]-5-pyrimidinecarboxylic acid ethyl ester IUPAC Name: ethyl 2-methylsulfanyl-4-[(3,4,5-trimethoxyphenyl)carbamoylamino]pyrimidine-5-carboxylate Traditional Name: 2-(methylthio)-4-[(3,4,5-trimethoxyphenyl)carbamoylamino]pyrimidine-5-carboxylic acid ethyl ester Formula: C18H22N4O6S MolecularWeight: 422.45548

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CN=C(N=C1NC(=O)NC2=CC(=C(C(=C2)OC)OC)OC)SC

Isomeric SMILES

CCOC(=O)C1=CN=C(N=C1NC(=O)NC2=CC(=C(C(=C2)OC)OC)OC)SC

InChI

InChI=1S/C18H22N4O6S/c1-6-28-16(23)11-9-19-18(29-5)22-15(11)21-17(24)20-10-7-12(25-2)14(27-4)13(8-10)26-3/h7-9H,6H2,1-5H3,(H2,19,20,21,22,24)