6-[(3,5-dimethyl-4-nitro-pyrazol-1-yl)methyl]-N2-(2-methylphenyl)-1,3,5-triazine-2,4-diamine

Systemtic Name: 6-[(3,5-dimethyl-4-nitro-pyrazol-1-yl)methyl]-N2-(2-methylphenyl)-1,3,5-triazine-2,4-diamine Openeye Name: 6-[(3,5-dimethyl-4-nitro-pyrazol-1-yl)methyl]-N2-(o-tolyl)-1,3,5-triazine-2,4-diamine CAS Name: 6-[(3,5-dimethyl-4-nitro-1-pyrazolyl)methyl]-N2-(2-methylphenyl)-1,3,5-triazine-2,4-diamine IUPAC Name: 6-[(3,5-dimethyl-4-nitropyrazol-1-yl)methyl]-2-N-(2-methylphenyl)-1,3,5-triazine-2,4-diamine Traditional Name: [4-amino-6-[(3,5-dimethyl-4-nitro-pyrazol-1-yl)methyl]-s-triazin-2-yl]-(o-tolyl)amine Formula: C16H18N8O2 MolecularWeight: 354.36652

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1NC2=NC(=NC(=N2)N)CN3C(=C(C(=N3)C)[N+](=O)[O-])C

Isomeric SMILES

CC1=CC=CC=C1NC2=NC(=NC(=N2)N)CN3C(=C(C(=N3)C)[N+](=O)[O-])C

InChI

InChI=1S/C16H18N8O2/c1-9-6-4-5-7-12(9)18-16-20-13(19-15(17)21-16)8-23-11(3)14(24(25)26)10(2)22-23/h4-7H,8H2,1-3H3,(H3,17,18,19,20,21)