N4-butyl-N2-(3,4-dichlorophenyl)-5-nitro-pyrimidine-2,4-diamine

Systemtic Name: N4-butyl-N2-(3,4-dichlorophenyl)-5-nitro-pyrimidine-2,4-diamine Openeye Name: N4-butyl-N2-(3,4-dichlorophenyl)-5-nitro-pyrimidine-2,4-diamine CAS Name: N4-butyl-N2-(3,4-dichlorophenyl)-5-nitropyrimidine-2,4-diamine IUPAC Name: 4-N-butyl-2-N-(3,4-dichlorophenyl)-5-nitropyrimidine-2,4-diamine Traditional Name: butyl-[2-(3,4-dichloroanilino)-5-nitro-pyrimidin-4-yl]amine Formula: C14H15Cl2N5O2 MolecularWeight: 356.2072

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC1=NC(=NC=C1[N+](=O)[O-])NC2=CC(=C(C=C2)Cl)Cl

Isomeric SMILES

CCCCNC1=NC(=NC=C1[N+](=O)[O-])NC2=CC(=C(C=C2)Cl)Cl

InChI

InChI=1S/C14H15Cl2N5O2/c1-2-3-6-17-13-12(21(22)23)8-18-14(20-13)19-9-4-5-10(15)11(16)7-9/h4-5,7-8H,2-3,6H2,1H3,(H2,17,18,19,20)