N6-butyl-N4-(3-methylphenyl)-5-nitro-pyrimidine-4,6-diamine

Systemtic Name: N6-butyl-N4-(3-methylphenyl)-5-nitro-pyrimidine-4,6-diamine Openeye Name: N6-butyl-N4-(m-tolyl)-5-nitro-pyrimidine-4,6-diamine CAS Name: N6-butyl-N4-(3-methylphenyl)-5-nitropyrimidine-4,6-diamine IUPAC Name: 6-N-butyl-4-N-(3-methylphenyl)-5-nitropyrimidine-4,6-diamine Traditional Name: butyl-[6-(m-toluidino)-5-nitro-pyrimidin-4-yl]amine Formula: C15H19N5O2 MolecularWeight: 301.34366

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H19N5O2/c1-3-4-8-16-14-13(20(21)22)15(18-10-17-14)19-12-7-5-6-11(2)9-12/h5-7,9-10H,3-4,8H2,1-2H3,(H2,16,17,18,19)