5-[4-[2-(4-nitrophenyl)ethylamino]phenyl]-6-(phenylmethoxymethyl)pyrimidine-2,4-diamine

Systemtic Name: 5-[4-[2-(4-nitrophenyl)ethylamino]phenyl]-6-(phenylmethoxymethyl)pyrimidine-2,4-diamine Openeye Name: 6-(benzyloxymethyl)-5-[4-[2-(4-nitrophenyl)ethylamino]phenyl]pyrimidine-2,4-diamine CAS Name: 5-[4-[2-(4-nitrophenyl)ethylamino]phenyl]-6-(phenylmethoxymethyl)pyrimidine-2,4-diamine IUPAC Name: 5-[4-[2-(4-nitrophenyl)ethylamino]phenyl]-6-(phenylmethoxymethyl)pyrimidine-2,4-diamine Traditional Name: [4-[2,4-diamino-6-(benzoxymethyl)pyrimidin-5-yl]phenyl]-[2-(4-nitrophenyl)ethyl]amine Formula: C26H26N6O3 MolecularWeight: 470.52304

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COCC2=C(C(=NC(=N2)N)N)C3=CC=C(C=C3)NCCC4=CC=C(C=C4)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)COCC2=C(C(=NC(=N2)N)N)C3=CC=C(C=C3)NCCC4=CC=C(C=C4)[N+](=O)[O-]

InChI

InChI=1S/C26H26N6O3/c27-25-24(23(30-26(28)31-25)17-35-16-19-4-2-1-3-5-19)20-8-10-21(11-9-20)29-15-14-18-6-12-22(13-7-18)32(33)34/h1-13,29H,14-17H2,(H4,27,28,30,31)