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

Systemtic Name: 2-methylpropyl 4-[(5-azanyl-6-naphthalen-2-yloxy-pyrimidin-4-yl)amino]benzoate Openeye Name: isobutyl 4-[[5-amino-6-(2-naphthyloxy)pyrimidin-4-yl]amino]benzoate CAS Name: 4-[[5-amino-6-(2-naphthalenyloxy)-4-pyrimidinyl]amino]benzoic acid 2-methylpropyl ester IUPAC Name: 2-methylpropyl 4-[(5-amino-6-naphthalen-2-yloxypyrimidin-4-yl)amino]benzoate Traditional Name: 4-[[5-amino-6-(2-naphthoxy)pyrimidin-4-yl]amino]benzoic acid isobutyl ester Formula: C25H24N4O3 MolecularWeight: 428.48306

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)COC(=O)C1=CC=C(C=C1)NC2=C(C(=NC=N2)OC3=CC4=CC=CC=C4C=C3)N

Isomeric SMILES

CC(C)COC(=O)C1=CC=C(C=C1)NC2=C(C(=NC=N2)OC3=CC4=CC=CC=C4C=C3)N

InChI

InChI=1S/C25H24N4O3/c1-16(2)14-31-25(30)18-7-10-20(11-8-18)29-23-22(26)24(28-15-27-23)32-21-12-9-17-5-3-4-6-19(17)13-21/h3-13,15-16H,14,26H2,1-2H3,(H,27,28,29)