N4-(2-chlorophenyl)-N6-[(4-methoxyphenyl)methyl]-5-nitro-pyrimidine-4,6-diamine

Systemtic Name: N4-(2-chlorophenyl)-N6-[(4-methoxyphenyl)methyl]-5-nitro-pyrimidine-4,6-diamine Openeye Name: N4-(2-chlorophenyl)-N6-[(4-methoxyphenyl)methyl]-5-nitro-pyrimidine-4,6-diamine CAS Name: N4-(2-chlorophenyl)-N6-[(4-methoxyphenyl)methyl]-5-nitropyrimidine-4,6-diamine IUPAC Name: 4-N-(2-chlorophenyl)-6-N-[(4-methoxyphenyl)methyl]-5-nitropyrimidine-4,6-diamine Traditional Name: [6-(2-chloroanilino)-5-nitro-pyrimidin-4-yl]-p-anisyl-amine Formula: C18H16ClN5O3 MolecularWeight: 385.80434

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=CC=C3Cl

Isomeric SMILES

COC1=CC=C(C=C1)CNC2=NC=NC(=C2[N+](=O)[O-])NC3=CC=CC=C3Cl

InChI

InChI=1S/C18H16ClN5O3/c1-27-13-8-6-12(7-9-13)10-20-17-16(24(25)26)18(22-11-21-17)23-15-5-3-2-4-14(15)19/h2-9,11H,10H2,1H3,(H2,20,21,22,23)