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

Systemtic Name: N4-(2-chlorophenyl)-N6-[(4-chlorophenyl)methyl]-5-nitro-pyrimidine-4,6-diamine Openeye Name: N4-(2-chlorophenyl)-N6-[(4-chlorophenyl)methyl]-5-nitro-pyrimidine-4,6-diamine CAS Name: N4-(2-chlorophenyl)-N6-[(4-chlorophenyl)methyl]-5-nitropyrimidine-4,6-diamine IUPAC Name: 4-N-(2-chlorophenyl)-6-N-[(4-chlorophenyl)methyl]-5-nitropyrimidine-4,6-diamine Traditional Name: [6-(2-chloroanilino)-5-nitro-pyrimidin-4-yl]-(4-chlorobenzyl)amine Formula: C17H13Cl2N5O2 MolecularWeight: 390.22342

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)NC2=C(C(=NC=N2)NCC3=CC=C(C=C3)Cl)[N+](=O)[O-])Cl

Isomeric SMILES

C1=CC=C(C(=C1)NC2=C(C(=NC=N2)NCC3=CC=C(C=C3)Cl)[N+](=O)[O-])Cl

InChI

InChI=1S/C17H13Cl2N5O2/c18-12-7-5-11(6-8-12)9-20-16-15(24(25)26)17(22-10-21-16)23-14-4-2-1-3-13(14)19/h1-8,10H,9H2,(H2,20,21,22,23)