N6-(2,5-dimethoxyphenyl)-N4-(5-methyl-1,2-oxazol-3-yl)pyrimidine-4,5,6-triamine

Systemtic Name: N6-(2,5-dimethoxyphenyl)-N4-(5-methyl-1,2-oxazol-3-yl)pyrimidine-4,5,6-triamine Openeye Name: N6-(2,5-dimethoxyphenyl)-N4-(5-methylisoxazol-3-yl)pyrimidine-4,5,6-triamine CAS Name: N6-(2,5-dimethoxyphenyl)-N4-(5-methyl-3-isoxazolyl)pyrimidine-4,5,6-triamine IUPAC Name: 6-N-(2,5-dimethoxyphenyl)-4-N-(5-methyl-1,2-oxazol-3-yl)pyrimidine-4,5,6-triamine Traditional Name: [5-amino-6-(2,5-dimethoxyanilino)pyrimidin-4-yl]-(5-methylisoxazol-3-yl)amine Formula: C16H18N6O3 MolecularWeight: 342.35252

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NO1)NC2=NC=NC(=C2N)NC3=C(C=CC(=C3)OC)OC

Isomeric SMILES

CC1=CC(=NO1)NC2=NC=NC(=C2N)NC3=C(C=CC(=C3)OC)OC

InChI

InChI=1S/C16H18N6O3/c1-9-6-13(22-25-9)21-16-14(17)15(18-8-19-16)20-11-7-10(23-2)4-5-12(11)24-3/h4-8H,17H2,1-3H3,(H2,18,19,20,21,22)