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

Systemtic Name: N6-[(4-chlorophenyl)methyl]-N4-(2,4-dichlorophenyl)-5-nitro-pyrimidine-4,6-diamine Openeye Name: N6-[(4-chlorophenyl)methyl]-N4-(2,4-dichlorophenyl)-5-nitro-pyrimidine-4,6-diamine CAS Name: N6-[(4-chlorophenyl)methyl]-N4-(2,4-dichlorophenyl)-5-nitropyrimidine-4,6-diamine IUPAC Name: 6-N-[(4-chlorophenyl)methyl]-4-N-(2,4-dichlorophenyl)-5-nitropyrimidine-4,6-diamine Traditional Name: (4-chlorobenzyl)-[6-(2,4-dichloroanilino)-5-nitro-pyrimidin-4-yl]amine Formula: C17H12Cl3N5O2 MolecularWeight: 424.66848

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CNC2=NC=NC(=C2[N+](=O)[O-])NC3=C(C=C(C=C3)Cl)Cl)Cl

Isomeric SMILES

C1=CC(=CC=C1CNC2=NC=NC(=C2[N+](=O)[O-])NC3=C(C=C(C=C3)Cl)Cl)Cl

InChI

InChI=1S/C17H12Cl3N5O2/c18-11-3-1-10(2-4-11)8-21-16-15(25(26)27)17(23-9-22-16)24-14-6-5-12(19)7-13(14)20/h1-7,9H,8H2,(H2,21,22,23,24)