O2-[4-[(5-ethoxycarbonyl-2-methylsulfanyl-pyrimidin-4-yl)amino]phenyl] O1-ethyl ethanedioate

Systemtic Name: O2-[4-[(5-ethoxycarbonyl-2-methylsulfanyl-pyrimidin-4-yl)amino]phenyl] O1-ethyl ethanedioate Openeye Name: O2-[4-[(5-ethoxycarbonyl-2-methylsulfanyl-pyrimidin-4-yl)amino]phenyl] O1-ethyl oxalate CAS Name: oxalic acid O2-[4-[[5-ethoxycarbonyl-2-(methylthio)-4-pyrimidinyl]amino]phenyl] ester O1-ethyl ester IUPAC Name: 2-O-[4-[(5-ethoxycarbonyl-2-methylsulfanylpyrimidin-4-yl)amino]phenyl] 1-O-ethyl oxalate Traditional Name: oxalic acid O2-[4-[[5-carbethoxy-2-(methylthio)pyrimidin-4-yl]amino]phenyl] ester O1-ethyl ester Formula: C18H19N3O6S MolecularWeight: 405.42496

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CN=C(N=C1NC2=CC=C(C=C2)OC(=O)C(=O)OCC)SC

Isomeric SMILES

CCOC(=O)C1=CN=C(N=C1NC2=CC=C(C=C2)OC(=O)C(=O)OCC)SC

InChI

InChI=1S/C18H19N3O6S/c1-4-25-15(22)13-10-19-18(28-3)21-14(13)20-11-6-8-12(9-7-11)27-17(24)16(23)26-5-2/h6-10H,4-5H2,1-3H3,(H,19,20,21)