N4-butyl-N6-(4-iodophenyl)-N4-methyl-5-nitro-pyrimidine-4,6-diamine

Systemtic Name: N4-butyl-N6-(4-iodophenyl)-N4-methyl-5-nitro-pyrimidine-4,6-diamine Openeye Name: N4-butyl-N6-(4-iodophenyl)-N4-methyl-5-nitro-pyrimidine-4,6-diamine CAS Name: N4-butyl-N6-(4-iodophenyl)-N4-methyl-5-nitropyrimidine-4,6-diamine IUPAC Name: 4-N-butyl-6-N-(4-iodophenyl)-4-N-methyl-5-nitropyrimidine-4,6-diamine Traditional Name: butyl-[6-(4-iodoanilino)-5-nitro-pyrimidin-4-yl]-methyl-amine Formula: C15H18IN5O2 MolecularWeight: 427.24019

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H18IN5O2/c1-3-4-9-20(2)15-13(21(22)23)14(17-10-18-15)19-12-7-5-11(16)6-8-12/h5-8,10H,3-4,9H2,1-2H3,(H,17,18,19)