N2-(3-methoxypropyl)-N4-(3-methylphenyl)-5-nitro-pyrimidine-2,4,6-triamine

Systemtic Name: N2-(3-methoxypropyl)-N4-(3-methylphenyl)-5-nitro-pyrimidine-2,4,6-triamine Openeye Name: N2-(3-methoxypropyl)-N4-(m-tolyl)-5-nitro-pyrimidine-2,4,6-triamine CAS Name: N2-(3-methoxypropyl)-N4-(3-methylphenyl)-5-nitropyrimidine-2,4,6-triamine IUPAC Name: 2-N-(3-methoxypropyl)-4-N-(3-methylphenyl)-5-nitropyrimidine-2,4,6-triamine Traditional Name: [6-amino-2-(3-methoxypropylamino)-5-nitro-pyrimidin-4-yl]-(m-tolyl)amine Formula: C15H20N6O3 MolecularWeight: 332.3577

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)NC2=NC(=NC(=C2[N+](=O)[O-])N)NCCCOC

Isomeric SMILES

CC1=CC(=CC=C1)NC2=NC(=NC(=C2[N+](=O)[O-])N)NCCCOC

InChI

InChI=1S/C15H20N6O3/c1-10-5-3-6-11(9-10)18-14-12(21(22)23)13(16)19-15(20-14)17-7-4-8-24-2/h3,5-6,9H,4,7-8H2,1-2H3,(H4,16,17,18,19,20)