N2-[3-(dimethylamino)propyl]-N4-(2-methoxyphenyl)-5-nitro-pyrimidine-2,4,6-triamine

Systemtic Name: N2-[3-(dimethylamino)propyl]-N4-(2-methoxyphenyl)-5-nitro-pyrimidine-2,4,6-triamine Openeye Name: N2-[3-(dimethylamino)propyl]-N4-(2-methoxyphenyl)-5-nitro-pyrimidine-2,4,6-triamine CAS Name: N2-[3-(dimethylamino)propyl]-N4-(2-methoxyphenyl)-5-nitropyrimidine-2,4,6-triamine IUPAC Name: 2-N-[3-(dimethylamino)propyl]-4-N-(2-methoxyphenyl)-5-nitropyrimidine-2,4,6-triamine Traditional Name: 3-[[4-amino-5-nitro-6-(o-anisidino)pyrimidin-2-yl]amino]propyl-dimethyl-amine Formula: C16H23N7O3 MolecularWeight: 361.39892

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)CCCNC1=NC(=C(C(=N1)NC2=CC=CC=C2OC)[N+](=O)[O-])N

Isomeric SMILES

CN(C)CCCNC1=NC(=C(C(=N1)NC2=CC=CC=C2OC)[N+](=O)[O-])N

InChI

InChI=1S/C16H23N7O3/c1-22(2)10-6-9-18-16-20-14(17)13(23(24)25)15(21-16)19-11-7-4-5-8-12(11)26-3/h4-5,7-8H,6,9-10H2,1-3H3,(H4,17,18,19,20,21)