N-[4-[2,4-bis(azanyl)-6-(phenylmethoxymethyl)pyrimidin-5-yl]phenyl]pyridine-4-carboxamide

Systemtic Name: N-[4-[2,4-bis(azanyl)-6-(phenylmethoxymethyl)pyrimidin-5-yl]phenyl]pyridine-4-carboxamide Openeye Name: N-[4-[2,4-diamino-6-(benzyloxymethyl)pyrimidin-5-yl]phenyl]pyridine-4-carboxamide CAS Name: N-[4-[2,4-diamino-6-(phenylmethoxymethyl)-5-pyrimidinyl]phenyl]-4-pyridinecarboxamide IUPAC Name: N-[4-[2,4-diamino-6-(phenylmethoxymethyl)pyrimidin-5-yl]phenyl]pyridine-4-carboxamide Traditional Name: N-[4-[2,4-diamino-6-(benzoxymethyl)pyrimidin-5-yl]phenyl]isonicotinamide Formula: C24H22N6O2 MolecularWeight: 426.47048

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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)C4=CC=NC=C4

Isomeric SMILES

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

InChI

InChI=1S/C24H22N6O2/c25-22-21(20(29-24(26)30-22)15-32-14-16-4-2-1-3-5-16)17-6-8-19(9-7-17)28-23(31)18-10-12-27-13-11-18/h1-13H,14-15H2,(H,28,31)(H4,25,26,29,30)