N2-(3-methylbutyl)-5-nitro-N4-phenyl-pyrimidine-2,4,6-triamine

Systemtic Name: N2-(3-methylbutyl)-5-nitro-N4-phenyl-pyrimidine-2,4,6-triamine Openeye Name: N2-isopentyl-5-nitro-N4-phenyl-pyrimidine-2,4,6-triamine CAS Name: N2-(3-methylbutyl)-5-nitro-N4-phenylpyrimidine-2,4,6-triamine IUPAC Name: 2-N-(3-methylbutyl)-5-nitro-4-N-phenylpyrimidine-2,4,6-triamine Traditional Name: (4-amino-6-anilino-5-nitro-pyrimidin-2-yl)-isoamyl-amine Formula: C15H20N6O2 MolecularWeight: 316.3583

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCNC1=NC(=C(C(=N1)NC2=CC=CC=C2)[N+](=O)[O-])N

Isomeric SMILES

CC(C)CCNC1=NC(=C(C(=N1)NC2=CC=CC=C2)[N+](=O)[O-])N

InChI

InChI=1S/C15H20N6O2/c1-10(2)8-9-17-15-19-13(16)12(21(22)23)14(20-15)18-11-6-4-3-5-7-11/h3-7,10H,8-9H2,1-2H3,(H4,16,17,18,19,20)