N2-tert-butyl-6-imidazol-1-yl-N4-(3-nitrophenyl)-1,3,5-triazine-2,4-diamine

Systemtic Name: N2-tert-butyl-6-imidazol-1-yl-N4-(3-nitrophenyl)-1,3,5-triazine-2,4-diamine Openeye Name: N2-tert-butyl-6-imidazol-1-yl-N4-(3-nitrophenyl)-1,3,5-triazine-2,4-diamine CAS Name: N2-tert-butyl-6-(1-imidazolyl)-N4-(3-nitrophenyl)-1,3,5-triazine-2,4-diamine IUPAC Name: 2-N-tert-butyl-6-imidazol-1-yl-4-N-(3-nitrophenyl)-1,3,5-triazine-2,4-diamine Traditional Name: tert-butyl-[4-imidazol-1-yl-6-(3-nitroanilino)-s-triazin-2-yl]amine Formula: C16H18N8O2 MolecularWeight: 354.36652

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)NC1=NC(=NC(=N1)NC2=CC(=CC=C2)[N+](=O)[O-])N3C=CN=C3

Isomeric SMILES

CC(C)(C)NC1=NC(=NC(=N1)NC2=CC(=CC=C2)[N+](=O)[O-])N3C=CN=C3

InChI

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