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

Systemtic Name: N4-(4-butylphenyl)-N6-methyl-5-nitro-pyrimidine-4,6-diamine Openeye Name: N4-(4-butylphenyl)-N6-methyl-5-nitro-pyrimidine-4,6-diamine CAS Name: N4-(4-butylphenyl)-N6-methyl-5-nitropyrimidine-4,6-diamine IUPAC Name: 4-N-(4-butylphenyl)-6-N-methyl-5-nitropyrimidine-4,6-diamine Traditional Name: [6-(4-butylanilino)-5-nitro-pyrimidin-4-yl]-methyl-amine Formula: C15H19N5O2 MolecularWeight: 301.34366

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C=C1)NC2=C(C(=NC=N2)NC)[N+](=O)[O-]

Isomeric SMILES

CCCCC1=CC=C(C=C1)NC2=C(C(=NC=N2)NC)[N+](=O)[O-]

InChI

InChI=1S/C15H19N5O2/c1-3-4-5-11-6-8-12(9-7-11)19-15-13(20(21)22)14(16-2)17-10-18-15/h6-10H,3-5H2,1-2H3,(H2,16,17,18,19)