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

Systemtic Name: methyl 4-[[5-azanyl-6-[(3-methoxyphenyl)amino]pyrimidin-4-yl]amino]benzoate Openeye Name: methyl 4-[[5-amino-6-(3-methoxyanilino)pyrimidin-4-yl]amino]benzoate CAS Name: 4-[[5-amino-6-(3-methoxyanilino)-4-pyrimidinyl]amino]benzoic acid methyl ester IUPAC Name: methyl 4-[[5-amino-6-(3-methoxyanilino)pyrimidin-4-yl]amino]benzoate Traditional Name: 4-[[5-amino-6-(m-anisidino)pyrimidin-4-yl]amino]benzoic acid methyl ester Formula: C19H19N5O3 MolecularWeight: 365.38586

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)NC2=NC=NC(=C2N)NC3=CC=C(C=C3)C(=O)OC

Isomeric SMILES

COC1=CC=CC(=C1)NC2=NC=NC(=C2N)NC3=CC=C(C=C3)C(=O)OC

InChI

InChI=1S/C19H19N5O3/c1-26-15-5-3-4-14(10-15)24-18-16(20)17(21-11-22-18)23-13-8-6-12(7-9-13)19(25)27-2/h3-11H,20H2,1-2H3,(H2,21,22,23,24)