N-(2-aminophenyl)-4-[[(2,6-dimethoxypyrimidin-4-yl)amino]methyl]benzamide

Systemtic Name: N-(2-aminophenyl)-4-[[(2,6-dimethoxypyrimidin-4-yl)amino]methyl]benzamide Openeye Name: N-(2-aminophenyl)-4-[[(2,6-dimethoxypyrimidin-4-yl)amino]methyl]benzamide CAS Name: N-(2-aminophenyl)-4-[[(2,6-dimethoxy-4-pyrimidinyl)amino]methyl]benzamide IUPAC Name: N-(2-aminophenyl)-4-[[(2,6-dimethoxypyrimidin-4-yl)amino]methyl]benzamide Traditional Name: N-(2-aminophenyl)-4-[[(2,6-dimethoxypyrimidin-4-yl)amino]methyl]benzamide Formula: C20H21N5O3 MolecularWeight: 379.41244

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Descriptors Computed from Structure

Canonical SMILES:

COC1=NC(=NC(=C1)NCC2=CC=C(C=C2)C(=O)NC3=CC=CC=C3N)OC

Isomeric SMILES

COC1=NC(=NC(=C1)NCC2=CC=C(C=C2)C(=O)NC3=CC=CC=C3N)OC

InChI

InChI=1S/C20H21N5O3/c1-27-18-11-17(24-20(25-18)28-2)22-12-13-7-9-14(10-8-13)19(26)23-16-6-4-3-5-15(16)21/h3-11H,12,21H2,1-2H3,(H,23,26)(H,22,24,25)