N2-(4-chlorophenyl)-N4-methyl-5-nitro-N4-[(2-nitrophenyl)methyl]pyrimidine-2,4-diamine

Systemtic Name: N2-(4-chlorophenyl)-N4-methyl-5-nitro-N4-[(2-nitrophenyl)methyl]pyrimidine-2,4-diamine Openeye Name: N2-(4-chlorophenyl)-N4-methyl-5-nitro-N4-[(2-nitrophenyl)methyl]pyrimidine-2,4-diamine CAS Name: N2-(4-chlorophenyl)-N4-methyl-5-nitro-N4-[(2-nitrophenyl)methyl]pyrimidine-2,4-diamine IUPAC Name: 2-N-(4-chlorophenyl)-4-N-methyl-5-nitro-4-N-[(2-nitrophenyl)methyl]pyrimidine-2,4-diamine Traditional Name: [2-(4-chloroanilino)-5-nitro-pyrimidin-4-yl]-methyl-(2-nitrobenzyl)amine Formula: C18H15ClN6O4 MolecularWeight: 414.8025

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=CC=CC=C1[N+](=O)[O-])C2=NC(=NC=C2[N+](=O)[O-])NC3=CC=C(C=C3)Cl

Isomeric SMILES

CN(CC1=CC=CC=C1[N+](=O)[O-])C2=NC(=NC=C2[N+](=O)[O-])NC3=CC=C(C=C3)Cl

InChI

InChI=1S/C18H15ClN6O4/c1-23(11-12-4-2-3-5-15(12)24(26)27)17-16(25(28)29)10-20-18(22-17)21-14-8-6-13(19)7-9-14/h2-10H,11H2,1H3,(H,20,21,22)