O1-ethyl O2-[3-[(2-methyl-6-phenyl-pyrimidin-4-yl)amino]phenyl] ethanedioate

Systemtic Name: O1-ethyl O2-[3-[(2-methyl-6-phenyl-pyrimidin-4-yl)amino]phenyl] ethanedioate Openeye Name: O1-ethyl O2-[3-[(2-methyl-6-phenyl-pyrimidin-4-yl)amino]phenyl] oxalate CAS Name: oxalic acid O1-ethyl ester O2-[3-[(2-methyl-6-phenyl-4-pyrimidinyl)amino]phenyl] ester IUPAC Name: 1-O-ethyl 2-O-[3-[(2-methyl-6-phenylpyrimidin-4-yl)amino]phenyl] oxalate Traditional Name: oxalic acid O1-ethyl ester O2-[3-[(2-methyl-6-phenyl-pyrimidin-4-yl)amino]phenyl] ester Formula: C21H19N3O4 MolecularWeight: 377.39326

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(=O)OC1=CC=CC(=C1)NC2=NC(=NC(=C2)C3=CC=CC=C3)C

Isomeric SMILES

CCOC(=O)C(=O)OC1=CC=CC(=C1)NC2=NC(=NC(=C2)C3=CC=CC=C3)C

InChI

InChI=1S/C21H19N3O4/c1-3-27-20(25)21(26)28-17-11-7-10-16(12-17)24-19-13-18(22-14(2)23-19)15-8-5-4-6-9-15/h4-13H,3H2,1-2H3,(H,22,23,24)