2-methylpropyl 4-[[5-azanyl-6-[(6-methylpyridin-2-yl)amino]pyrimidin-4-yl]amino]benzoate

Systemtic Name: 2-methylpropyl 4-[[5-azanyl-6-[(6-methylpyridin-2-yl)amino]pyrimidin-4-yl]amino]benzoate Openeye Name: isobutyl 4-[[5-amino-6-[(6-methyl-2-pyridyl)amino]pyrimidin-4-yl]amino]benzoate CAS Name: 4-[[5-amino-6-[(6-methyl-2-pyridinyl)amino]-4-pyrimidinyl]amino]benzoic acid 2-methylpropyl ester IUPAC Name: 2-methylpropyl 4-[[5-amino-6-[(6-methylpyridin-2-yl)amino]pyrimidin-4-yl]amino]benzoate Traditional Name: 4-[[5-amino-6-[(6-methyl-2-pyridyl)amino]pyrimidin-4-yl]amino]benzoic acid isobutyl ester Formula: C21H24N6O2 MolecularWeight: 392.45426

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=CC=C1)NC2=NC=NC(=C2N)NC3=CC=C(C=C3)C(=O)OCC(C)C

Isomeric SMILES

CC1=NC(=CC=C1)NC2=NC=NC(=C2N)NC3=CC=C(C=C3)C(=O)OCC(C)C

InChI

InChI=1S/C21H24N6O2/c1-13(2)11-29-21(28)15-7-9-16(10-8-15)26-19-18(22)20(24-12-23-19)27-17-6-4-5-14(3)25-17/h4-10,12-13H,11,22H2,1-3H3,(H2,23,24,25,26,27)