4-[5-[[2,4-bis(azanyl)pyrimidin-5-yl]methyl]-2,3-dimethoxy-phenyl]benzamide

Systemtic Name: 4-[5-[[2,4-bis(azanyl)pyrimidin-5-yl]methyl]-2,3-dimethoxy-phenyl]benzamide Openeye Name: 4-[5-[(2,4-diaminopyrimidin-5-yl)methyl]-2,3-dimethoxy-phenyl]benzamide CAS Name: 4-[5-[(2,4-diamino-5-pyrimidinyl)methyl]-2,3-dimethoxyphenyl]benzamide IUPAC Name: 4-[5-[(2,4-diaminopyrimidin-5-yl)methyl]-2,3-dimethoxyphenyl]benzamide Traditional Name: 4-[5-[(2,4-diaminopyrimidin-5-yl)methyl]-2,3-dimethoxy-phenyl]benzamide Formula: C20H21N5O3 MolecularWeight: 379.41244

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=CC(=C1)CC2=CN=C(N=C2N)N)C3=CC=C(C=C3)C(=O)N)OC

Isomeric SMILES

COC1=C(C(=CC(=C1)CC2=CN=C(N=C2N)N)C3=CC=C(C=C3)C(=O)N)OC

InChI

InChI=1S/C20H21N5O3/c1-27-16-9-11(7-14-10-24-20(23)25-18(14)21)8-15(17(16)28-2)12-3-5-13(6-4-12)19(22)26/h3-6,8-10H,7H2,1-2H3,(H2,22,26)(H4,21,23,24,25)