N4-[(4-methoxyphenyl)methyl]-N6-methyl-5-nitro-pyrimidine-4,6-diamine

Systemtic Name: N4-[(4-methoxyphenyl)methyl]-N6-methyl-5-nitro-pyrimidine-4,6-diamine Openeye Name: N4-[(4-methoxyphenyl)methyl]-N6-methyl-5-nitro-pyrimidine-4,6-diamine CAS Name: N4-[(4-methoxyphenyl)methyl]-N6-methyl-5-nitropyrimidine-4,6-diamine IUPAC Name: 4-N-[(4-methoxyphenyl)methyl]-6-N-methyl-5-nitropyrimidine-4,6-diamine Traditional Name: methyl-[5-nitro-6-(p-anisylamino)pyrimidin-4-yl]amine Formula: C13H15N5O3 MolecularWeight: 289.2899

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Descriptors Computed from Structure

Canonical SMILES:

CNC1=C(C(=NC=N1)NCC2=CC=C(C=C2)OC)[N+](=O)[O-]

Isomeric SMILES

CNC1=C(C(=NC=N1)NCC2=CC=C(C=C2)OC)[N+](=O)[O-]

InChI

InChI=1S/C13H15N5O3/c1-14-12-11(18(19)20)13(17-8-16-12)15-7-9-3-5-10(21-2)6-4-9/h3-6,8H,7H2,1-2H3,(H2,14,15,16,17)