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

Systemtic Name: N6-[2,3-bis(chloranyl)phenyl]-N4-butyl-N4-methyl-5-nitro-pyrimidine-4,6-diamine Openeye Name: N4-butyl-N6-(2,3-dichlorophenyl)-N4-methyl-5-nitro-pyrimidine-4,6-diamine CAS Name: N4-butyl-N6-(2,3-dichlorophenyl)-N4-methyl-5-nitropyrimidine-4,6-diamine IUPAC Name: 4-N-butyl-6-N-(2,3-dichlorophenyl)-4-N-methyl-5-nitropyrimidine-4,6-diamine Traditional Name: butyl-[6-(2,3-dichloroanilino)-5-nitro-pyrimidin-4-yl]-methyl-amine Formula: C15H17Cl2N5O2 MolecularWeight: 370.23378

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H17Cl2N5O2/c1-3-4-8-21(2)15-13(22(23)24)14(18-9-19-15)20-11-7-5-6-10(16)12(11)17/h5-7,9H,3-4,8H2,1-2H3,(H,18,19,20)