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

Systemtic Name: N6-[(2-chlorophenyl)methyl]-N4-(4-ethoxyphenyl)-5-nitro-pyrimidine-4,6-diamine Openeye Name: N6-[(2-chlorophenyl)methyl]-N4-(4-ethoxyphenyl)-5-nitro-pyrimidine-4,6-diamine CAS Name: N6-[(2-chlorophenyl)methyl]-N4-(4-ethoxyphenyl)-5-nitropyrimidine-4,6-diamine IUPAC Name: 6-N-[(2-chlorophenyl)methyl]-4-N-(4-ethoxyphenyl)-5-nitropyrimidine-4,6-diamine Traditional Name: (2-chlorobenzyl)-[5-nitro-6-(p-phenetidino)pyrimidin-4-yl]amine Formula: C19H18ClN5O3 MolecularWeight: 399.83092

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)NC2=C(C(=NC=N2)NCC3=CC=CC=C3Cl)[N+](=O)[O-]

Isomeric SMILES

CCOC1=CC=C(C=C1)NC2=C(C(=NC=N2)NCC3=CC=CC=C3Cl)[N+](=O)[O-]

InChI

InChI=1S/C19H18ClN5O3/c1-2-28-15-9-7-14(8-10-15)24-19-17(25(26)27)18(22-12-23-19)21-11-13-5-3-4-6-16(13)20/h3-10,12H,2,11H2,1H3,(H2,21,22,23,24)