N2-(4-chlorophenyl)-5-nitro-N4-[2-[(4-nitropyridin-2-yl)amino]ethyl]pyrimidine-2,4-diamine

Systemtic Name: N2-(4-chlorophenyl)-5-nitro-N4-[2-[(4-nitropyridin-2-yl)amino]ethyl]pyrimidine-2,4-diamine Openeye Name: N2-(4-chlorophenyl)-5-nitro-N4-[2-[(4-nitro-2-pyridyl)amino]ethyl]pyrimidine-2,4-diamine CAS Name: N2-(4-chlorophenyl)-5-nitro-N4-[2-[(4-nitro-2-pyridinyl)amino]ethyl]pyrimidine-2,4-diamine IUPAC Name: 2-N-(4-chlorophenyl)-5-nitro-4-N-[2-[(4-nitropyridin-2-yl)amino]ethyl]pyrimidine-2,4-diamine Traditional Name: [2-(4-chloroanilino)-5-nitro-pyrimidin-4-yl]-[2-[(4-nitro-2-pyridyl)amino]ethyl]amine Formula: C17H15ClN8O4 MolecularWeight: 430.8052

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1NC2=NC=C(C(=N2)NCCNC3=NC=CC(=C3)[N+](=O)[O-])[N+](=O)[O-])Cl

Isomeric SMILES

C1=CC(=CC=C1NC2=NC=C(C(=N2)NCCNC3=NC=CC(=C3)[N+](=O)[O-])[N+](=O)[O-])Cl

InChI

InChI=1S/C17H15ClN8O4/c18-11-1-3-12(4-2-11)23-17-22-10-14(26(29)30)16(24-17)21-8-7-20-15-9-13(25(27)28)5-6-19-15/h1-6,9-10H,7-8H2,(H,19,20)(H2,21,22,23,24)