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

Systemtic Name: N4-[2,3-bis(chloranyl)phenyl]-5-nitro-N6-propyl-pyrimidine-4,6-diamine Openeye Name: N4-(2,3-dichlorophenyl)-5-nitro-N6-propyl-pyrimidine-4,6-diamine CAS Name: N4-(2,3-dichlorophenyl)-5-nitro-N6-propylpyrimidine-4,6-diamine IUPAC Name: 4-N-(2,3-dichlorophenyl)-5-nitro-6-N-propylpyrimidine-4,6-diamine Traditional Name: [6-(2,3-dichloroanilino)-5-nitro-pyrimidin-4-yl]-propyl-amine Formula: C13H13Cl2N5O2 MolecularWeight: 342.18062

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Descriptors Computed from Structure

Canonical SMILES:

CCCNC1=NC=NC(=C1[N+](=O)[O-])NC2=C(C(=CC=C2)Cl)Cl

Isomeric SMILES

CCCNC1=NC=NC(=C1[N+](=O)[O-])NC2=C(C(=CC=C2)Cl)Cl

InChI

InChI=1S/C13H13Cl2N5O2/c1-2-6-16-12-11(20(21)22)13(18-7-17-12)19-9-5-3-4-8(14)10(9)15/h3-5,7H,2,6H2,1H3,(H2,16,17,18,19)