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

Systemtic Name: N4-(4-methylphenyl)-5-nitro-N6-propyl-pyrimidine-4,6-diamine Openeye Name: 5-nitro-N6-propyl-N4-(p-tolyl)pyrimidine-4,6-diamine CAS Name: N4-(4-methylphenyl)-5-nitro-N6-propylpyrimidine-4,6-diamine IUPAC Name: 4-N-(4-methylphenyl)-5-nitro-6-N-propylpyrimidine-4,6-diamine Traditional Name: [5-nitro-6-(propylamino)pyrimidin-4-yl]-(p-tolyl)amine Formula: C14H17N5O2 MolecularWeight: 287.31708

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Descriptors Computed from Structure

Canonical SMILES:

CCCNC1=NC=NC(=C1[N+](=O)[O-])NC2=CC=C(C=C2)C

Isomeric SMILES

CCCNC1=NC=NC(=C1[N+](=O)[O-])NC2=CC=C(C=C2)C

InChI

InChI=1S/C14H17N5O2/c1-3-8-15-13-12(19(20)21)14(17-9-16-13)18-11-6-4-10(2)5-7-11/h4-7,9H,3,8H2,1-2H3,(H2,15,16,17,18)