6-(phenylmethoxymethyl)-5-[4-(1-pyridin-4-ylethylamino)phenyl]pyrimidine-2,4-diamine

Systemtic Name: 6-(phenylmethoxymethyl)-5-[4-(1-pyridin-4-ylethylamino)phenyl]pyrimidine-2,4-diamine Openeye Name: 6-(benzyloxymethyl)-5-[4-[1-(4-pyridyl)ethylamino]phenyl]pyrimidine-2,4-diamine CAS Name: 6-(phenylmethoxymethyl)-5-[4-(1-pyridin-4-ylethylamino)phenyl]pyrimidine-2,4-diamine IUPAC Name: 6-(phenylmethoxymethyl)-5-[4-(1-pyridin-4-ylethylamino)phenyl]pyrimidine-2,4-diamine Traditional Name: [4-[2,4-diamino-6-(benzoxymethyl)pyrimidin-5-yl]phenyl]-[1-(4-pyridyl)ethyl]amine Formula: C25H26N6O MolecularWeight: 426.51354

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=NC=C1)NC2=CC=C(C=C2)C3=C(N=C(N=C3N)N)COCC4=CC=CC=C4

Isomeric SMILES

CC(C1=CC=NC=C1)NC2=CC=C(C=C2)C3=C(N=C(N=C3N)N)COCC4=CC=CC=C4

InChI

InChI=1S/C25H26N6O/c1-17(19-11-13-28-14-12-19)29-21-9-7-20(8-10-21)23-22(30-25(27)31-24(23)26)16-32-15-18-5-3-2-4-6-18/h2-14,17,29H,15-16H2,1H3,(H4,26,27,30,31)