N-[4,6-bis(azanyl)pyrimidin-5-yl]-3,5-bis(phenylmethoxy)benzamide

Systemtic Name: N-[4,6-bis(azanyl)pyrimidin-5-yl]-3,5-bis(phenylmethoxy)benzamide Openeye Name: 3,5-dibenzyloxy-N-(4,6-diaminopyrimidin-5-yl)benzamide CAS Name: N-(4,6-diamino-5-pyrimidinyl)-3,5-bis(phenylmethoxy)benzamide IUPAC Name: N-(4,6-diaminopyrimidin-5-yl)-3,5-bis(phenylmethoxy)benzamide Traditional Name: 3,5-dibenzoxy-N-(4,6-diaminopyrimidin-5-yl)benzamide Formula: C25H23N5O3 MolecularWeight: 441.48182

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COC2=CC(=CC(=C2)C(=O)NC3=C(N=CN=C3N)N)OCC4=CC=CC=C4

Isomeric SMILES

C1=CC=C(C=C1)COC2=CC(=CC(=C2)C(=O)NC3=C(N=CN=C3N)N)OCC4=CC=CC=C4

InChI

InChI=1S/C25H23N5O3/c26-23-22(24(27)29-16-28-23)30-25(31)19-11-20(32-14-17-7-3-1-4-8-17)13-21(12-19)33-15-18-9-5-2-6-10-18/h1-13,16H,14-15H2,(H,30,31)(H4,26,27,28,29)