N4-(2-ethylphenyl)-5-nitro-N6-(phenylmethyl)pyrimidine-4,6-diamine

Systemtic Name: N4-(2-ethylphenyl)-5-nitro-N6-(phenylmethyl)pyrimidine-4,6-diamine Openeye Name: N6-benzyl-N4-(2-ethylphenyl)-5-nitro-pyrimidine-4,6-diamine CAS Name: N4-(2-ethylphenyl)-5-nitro-N6-(phenylmethyl)pyrimidine-4,6-diamine IUPAC Name: 6-N-benzyl-4-N-(2-ethylphenyl)-5-nitropyrimidine-4,6-diamine Traditional Name: benzyl-[6-(2-ethylanilino)-5-nitro-pyrimidin-4-yl]amine Formula: C19H19N5O2 MolecularWeight: 349.38646

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=CC=C1NC2=C(C(=NC=N2)NCC3=CC=CC=C3)[N+](=O)[O-]

Isomeric SMILES

CCC1=CC=CC=C1NC2=C(C(=NC=N2)NCC3=CC=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C19H19N5O2/c1-2-15-10-6-7-11-16(15)23-19-17(24(25)26)18(21-13-22-19)20-12-14-8-4-3-5-9-14/h3-11,13H,2,12H2,1H3,(H2,20,21,22,23)