N4-(5-chloranyl-2,4-dimethoxy-phenyl)-N6-(2,4-dichlorophenyl)-5-nitro-pyrimidine-4,6-diamine

Systemtic Name: N4-(5-chloranyl-2,4-dimethoxy-phenyl)-N6-(2,4-dichlorophenyl)-5-nitro-pyrimidine-4,6-diamine Openeye Name: N4-(5-chloro-2,4-dimethoxy-phenyl)-N6-(2,4-dichlorophenyl)-5-nitro-pyrimidine-4,6-diamine CAS Name: N4-(5-chloro-2,4-dimethoxyphenyl)-N6-(2,4-dichlorophenyl)-5-nitropyrimidine-4,6-diamine IUPAC Name: 4-N-(5-chloro-2,4-dimethoxyphenyl)-6-N-(2,4-dichlorophenyl)-5-nitropyrimidine-4,6-diamine Traditional Name: [6-(5-chloro-2,4-dimethoxy-anilino)-5-nitro-pyrimidin-4-yl]-(2,4-dichlorophenyl)amine Formula: C18H14Cl3N5O4 MolecularWeight: 470.69386

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1NC2=NC=NC(=C2[N+](=O)[O-])NC3=C(C=C(C=C3)Cl)Cl)Cl)OC

Isomeric SMILES

COC1=CC(=C(C=C1NC2=NC=NC(=C2[N+](=O)[O-])NC3=C(C=C(C=C3)Cl)Cl)Cl)OC

InChI

InChI=1S/C18H14Cl3N5O4/c1-29-14-7-15(30-2)13(6-11(14)21)25-18-16(26(27)28)17(22-8-23-18)24-12-4-3-9(19)5-10(12)20/h3-8H,1-2H3,(H2,22,23,24,25)