N4-[2,3-bis(chloranyl)phenyl]-5-nitro-N6-(pyridin-3-ylmethyl)pyrimidine-4,6-diamine

Systemtic Name: N4-[2,3-bis(chloranyl)phenyl]-5-nitro-N6-(pyridin-3-ylmethyl)pyrimidine-4,6-diamine Openeye Name: N4-(2,3-dichlorophenyl)-5-nitro-N6-(3-pyridylmethyl)pyrimidine-4,6-diamine CAS Name: N4-(2,3-dichlorophenyl)-5-nitro-N6-(3-pyridinylmethyl)pyrimidine-4,6-diamine IUPAC Name: 4-N-(2,3-dichlorophenyl)-5-nitro-6-N-(pyridin-3-ylmethyl)pyrimidine-4,6-diamine Traditional Name: [6-(2,3-dichloroanilino)-5-nitro-pyrimidin-4-yl]-(3-pyridylmethyl)amine Formula: C16H12Cl2N6O2 MolecularWeight: 391.21148

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C(=C1)Cl)Cl)NC2=C(C(=NC=N2)NCC3=CN=CC=C3)[N+](=O)[O-]

Isomeric SMILES

C1=CC(=C(C(=C1)Cl)Cl)NC2=C(C(=NC=N2)NCC3=CN=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C16H12Cl2N6O2/c17-11-4-1-5-12(13(11)18)23-16-14(24(25)26)15(21-9-22-16)20-8-10-3-2-6-19-7-10/h1-7,9H,8H2,(H2,20,21,22,23)