ethyl 2-[[5-azanyl-6-[(3-methoxyphenyl)amino]pyrimidin-4-yl]amino]benzoate

Systemtic Name: ethyl 2-[[5-azanyl-6-[(3-methoxyphenyl)amino]pyrimidin-4-yl]amino]benzoate Openeye Name: ethyl 2-[[5-amino-6-(3-methoxyanilino)pyrimidin-4-yl]amino]benzoate CAS Name: 2-[[5-amino-6-(3-methoxyanilino)-4-pyrimidinyl]amino]benzoic acid ethyl ester IUPAC Name: ethyl 2-[[5-amino-6-(3-methoxyanilino)pyrimidin-4-yl]amino]benzoate Traditional Name: 2-[[5-amino-6-(m-anisidino)pyrimidin-4-yl]amino]benzoic acid ethyl ester Formula: C20H21N5O3 MolecularWeight: 379.41244

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=CC=C1NC2=NC=NC(=C2N)NC3=CC(=CC=C3)OC

Isomeric SMILES

CCOC(=O)C1=CC=CC=C1NC2=NC=NC(=C2N)NC3=CC(=CC=C3)OC

InChI

InChI=1S/C20H21N5O3/c1-3-28-20(26)15-9-4-5-10-16(15)25-19-17(21)18(22-12-23-19)24-13-7-6-8-14(11-13)27-2/h4-12H,3,21H2,1-2H3,(H2,22,23,24,25)