dimethyl 5-[[5-azanyl-6-[(5-methyl-1,2-oxazol-3-yl)amino]pyrimidin-4-yl]amino]benzene-1,3-dicarboxylate

Systemtic Name: dimethyl 5-[[5-azanyl-6-[(5-methyl-1,2-oxazol-3-yl)amino]pyrimidin-4-yl]amino]benzene-1,3-dicarboxylate Openeye Name: dimethyl 5-[[5-amino-6-[(5-methylisoxazol-3-yl)amino]pyrimidin-4-yl]amino]benzene-1,3-dicarboxylate CAS Name: 5-[[5-amino-6-[(5-methyl-3-isoxazolyl)amino]-4-pyrimidinyl]amino]benzene-1,3-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl 5-[[5-amino-6-[(5-methyl-1,2-oxazol-3-yl)amino]pyrimidin-4-yl]amino]benzene-1,3-dicarboxylate Traditional Name: 5-[[5-amino-6-[(5-methylisoxazol-3-yl)amino]pyrimidin-4-yl]amino]benzene-1,3-dicarboxylic acid dimethyl ester Formula: C18H18N6O5 MolecularWeight: 398.37272

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H18N6O5/c1-9-4-13(24-29-9)23-16-14(19)15(20-8-21-16)22-12-6-10(17(25)27-2)5-11(7-12)18(26)28-3/h4-8H,19H2,1-3H3,(H2,20,21,22,23,24)