N2,N4-dicyclopropyl-N2-[(4-methoxyphenyl)methyl]-5-nitro-pyrimidine-2,4-diamine

Systemtic Name: N2,N4-dicyclopropyl-N2-[(4-methoxyphenyl)methyl]-5-nitro-pyrimidine-2,4-diamine Openeye Name: N2,N4-dicyclopropyl-N2-[(4-methoxyphenyl)methyl]-5-nitro-pyrimidine-2,4-diamine CAS Name: N2,N4-dicyclopropyl-N2-[(4-methoxyphenyl)methyl]-5-nitropyrimidine-2,4-diamine IUPAC Name: 2-N,4-N-dicyclopropyl-2-N-[(4-methoxyphenyl)methyl]-5-nitropyrimidine-2,4-diamine Traditional Name: cyclopropyl-[4-(cyclopropylamino)-5-nitro-pyrimidin-2-yl]-p-anisyl-amine Formula: C18H21N5O3 MolecularWeight: 355.39104

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)CN(C2CC2)C3=NC=C(C(=N3)NC4CC4)[N+](=O)[O-]

Isomeric SMILES

COC1=CC=C(C=C1)CN(C2CC2)C3=NC=C(C(=N3)NC4CC4)[N+](=O)[O-]

InChI

InChI=1S/C18H21N5O3/c1-26-15-8-2-12(3-9-15)11-22(14-6-7-14)18-19-10-16(23(24)25)17(21-18)20-13-4-5-13/h2-3,8-10,13-14H,4-7,11H2,1H3,(H,19,20,21)