N4-(2-methoxy-5-methyl-phenyl)-5-nitro-N6-propyl-pyrimidine-4,6-diamine

Systemtic Name: N4-(2-methoxy-5-methyl-phenyl)-5-nitro-N6-propyl-pyrimidine-4,6-diamine Openeye Name: N4-(2-methoxy-5-methyl-phenyl)-5-nitro-N6-propyl-pyrimidine-4,6-diamine CAS Name: N4-(2-methoxy-5-methylphenyl)-5-nitro-N6-propylpyrimidine-4,6-diamine IUPAC Name: 4-N-(2-methoxy-5-methylphenyl)-5-nitro-6-N-propylpyrimidine-4,6-diamine Traditional Name: [6-(2-methoxy-5-methyl-anilino)-5-nitro-pyrimidin-4-yl]-propyl-amine Formula: C15H19N5O3 MolecularWeight: 317.34306

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H19N5O3/c1-4-7-16-14-13(20(21)22)15(18-9-17-14)19-11-8-10(2)5-6-12(11)23-3/h5-6,8-9H,4,7H2,1-3H3,(H2,16,17,18,19)