methyl 3-[[4-(1H-indazol-4-ylamino)pyrimidin-2-yl]amino]benzoate

Systemtic Name: methyl 3-[[4-(1H-indazol-4-ylamino)pyrimidin-2-yl]amino]benzoate Openeye Name: methyl 3-[[4-(1H-indazol-4-ylamino)pyrimidin-2-yl]amino]benzoate CAS Name: 3-[[4-(1H-indazol-4-ylamino)-2-pyrimidinyl]amino]benzoic acid methyl ester IUPAC Name: methyl 3-[[4-(1H-indazol-4-ylamino)pyrimidin-2-yl]amino]benzoate Traditional Name: 3-[[4-(1H-indazol-4-ylamino)pyrimidin-2-yl]amino]benzoic acid methyl ester Formula: C19H16N6O2 MolecularWeight: 360.36934

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC(=CC=C1)NC2=NC=CC(=N2)NC3=CC=CC4=C3C=NN4

Isomeric SMILES

COC(=O)C1=CC(=CC=C1)NC2=NC=CC(=N2)NC3=CC=CC4=C3C=NN4

InChI

InChI=1S/C19H16N6O2/c1-27-18(26)12-4-2-5-13(10-12)22-19-20-9-8-17(24-19)23-15-6-3-7-16-14(15)11-21-25-16/h2-11H,1H3,(H,21,25)(H2,20,22,23,24)