N-(5-chloranylpyridin-2-yl)-6-[4-(3-chlorophenyl)piperazin-1-yl]-5-nitro-pyrimidin-4-amine

Systemtic Name: N-(5-chloranylpyridin-2-yl)-6-[4-(3-chlorophenyl)piperazin-1-yl]-5-nitro-pyrimidin-4-amine Openeye Name: 6-[4-(3-chlorophenyl)piperazin-1-yl]-N-(5-chloro-2-pyridyl)-5-nitro-pyrimidin-4-amine CAS Name: 6-[4-(3-chlorophenyl)-1-piperazinyl]-N-(5-chloro-2-pyridinyl)-5-nitro-4-pyrimidinamine IUPAC Name: 6-[4-(3-chlorophenyl)piperazin-1-yl]-N-(5-chloropyridin-2-yl)-5-nitropyrimidin-4-amine Traditional Name: [6-[4-(3-chlorophenyl)piperazino]-5-nitro-pyrimidin-4-yl]-(5-chloro-2-pyridyl)amine Formula: C19H17Cl2N7O2 MolecularWeight: 446.28998

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC(=CC=C2)Cl)C3=C(C(=NC=N3)NC4=NC=C(C=C4)Cl)[N+](=O)[O-]

Isomeric SMILES

C1CN(CCN1C2=CC(=CC=C2)Cl)C3=C(C(=NC=N3)NC4=NC=C(C=C4)Cl)[N+](=O)[O-]

InChI

InChI=1S/C19H17Cl2N7O2/c20-13-2-1-3-15(10-13)26-6-8-27(9-7-26)19-17(28(29)30)18(23-12-24-19)25-16-5-4-14(21)11-22-16/h1-5,10-12H,6-9H2,(H,22,23,24,25)