N-[4-[2,4-bis(azanyl)-6-(phenylmethoxymethyl)pyrimidin-5-yl]phenyl]-2-pyridin-3-yl-ethanamide

Systemtic Name: N-[4-[2,4-bis(azanyl)-6-(phenylmethoxymethyl)pyrimidin-5-yl]phenyl]-2-pyridin-3-yl-ethanamide Openeye Name: N-[4-[2,4-diamino-6-(benzyloxymethyl)pyrimidin-5-yl]phenyl]-2-(3-pyridyl)acetamide CAS Name: N-[4-[2,4-diamino-6-(phenylmethoxymethyl)-5-pyrimidinyl]phenyl]-2-(3-pyridinyl)acetamide IUPAC Name: N-[4-[2,4-diamino-6-(phenylmethoxymethyl)pyrimidin-5-yl]phenyl]-2-pyridin-3-ylacetamide Traditional Name: N-[4-[2,4-diamino-6-(benzoxymethyl)pyrimidin-5-yl]phenyl]-2-(3-pyridyl)acetamide Formula: C25H24N6O2 MolecularWeight: 440.49706

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COCC2=C(C(=NC(=N2)N)N)C3=CC=C(C=C3)NC(=O)CC4=CN=CC=C4

Isomeric SMILES

C1=CC=C(C=C1)COCC2=C(C(=NC(=N2)N)N)C3=CC=C(C=C3)NC(=O)CC4=CN=CC=C4

InChI

InChI=1S/C25H24N6O2/c26-24-23(21(30-25(27)31-24)16-33-15-17-5-2-1-3-6-17)19-8-10-20(11-9-19)29-22(32)13-18-7-4-12-28-14-18/h1-12,14H,13,15-16H2,(H,29,32)(H4,26,27,30,31)