N-(4-chlorophenyl)-5-nitro-4-[4-(2-nitrophenyl)piperazin-1-yl]pyrimidin-2-amine

Systemtic Name: N-(4-chlorophenyl)-5-nitro-4-[4-(2-nitrophenyl)piperazin-1-yl]pyrimidin-2-amine Openeye Name: N-(4-chlorophenyl)-5-nitro-4-[4-(2-nitrophenyl)piperazin-1-yl]pyrimidin-2-amine CAS Name: N-(4-chlorophenyl)-5-nitro-4-[4-(2-nitrophenyl)-1-piperazinyl]-2-pyrimidinamine IUPAC Name: N-(4-chlorophenyl)-5-nitro-4-[4-(2-nitrophenyl)piperazin-1-yl]pyrimidin-2-amine Traditional Name: (4-chlorophenyl)-[5-nitro-4-[4-(2-nitrophenyl)piperazino]pyrimidin-2-yl]amine Formula: C20H18ClN7O4 MolecularWeight: 455.85442

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC=CC=C2[N+](=O)[O-])C3=NC(=NC=C3[N+](=O)[O-])NC4=CC=C(C=C4)Cl

Isomeric SMILES

C1CN(CCN1C2=CC=CC=C2[N+](=O)[O-])C3=NC(=NC=C3[N+](=O)[O-])NC4=CC=C(C=C4)Cl

InChI

InChI=1S/C20H18ClN7O4/c21-14-5-7-15(8-6-14)23-20-22-13-18(28(31)32)19(24-20)26-11-9-25(10-12-26)16-3-1-2-4-17(16)27(29)30/h1-8,13H,9-12H2,(H,22,23,24)