N6-[(4-methoxyphenyl)methyl]-5-nitro-N4-(4-phenyldiazenylphenyl)pyrimidine-4,6-diamine

Systemtic Name: N6-[(4-methoxyphenyl)methyl]-5-nitro-N4-(4-phenyldiazenylphenyl)pyrimidine-4,6-diamine Openeye Name: N6-[(4-methoxyphenyl)methyl]-5-nitro-N4-(4-phenylazophenyl)pyrimidine-4,6-diamine CAS Name: N6-[(4-methoxyphenyl)methyl]-5-nitro-N4-(4-phenyldiazenylphenyl)pyrimidine-4,6-diamine IUPAC Name: 6-N-[(4-methoxyphenyl)methyl]-5-nitro-4-N-(4-phenyldiazenylphenyl)pyrimidine-4,6-diamine Traditional Name: [5-nitro-6-(p-anisylamino)pyrimidin-4-yl]-(4-phenylazophenyl)amine Formula: C24H21N7O3 MolecularWeight: 455.46864

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)CNC2=NC=NC(=C2[N+](=O)[O-])NC3=CC=C(C=C3)N=NC4=CC=CC=C4

Isomeric SMILES

COC1=CC=C(C=C1)CNC2=NC=NC(=C2[N+](=O)[O-])NC3=CC=C(C=C3)N=NC4=CC=CC=C4

InChI

InChI=1S/C24H21N7O3/c1-34-21-13-7-17(8-14-21)15-25-23-22(31(32)33)24(27-16-26-23)28-18-9-11-20(12-10-18)30-29-19-5-3-2-4-6-19/h2-14,16H,15H2,1H3,(H2,25,26,27,28)