N4-(4-bromophenyl)-N4-butyl-5-nitroso-pyrimidine-2,4,6-triamine

Systemtic Name: N4-(4-bromophenyl)-N4-butyl-5-nitroso-pyrimidine-2,4,6-triamine Openeye Name: N4-(4-bromophenyl)-N4-butyl-5-nitroso-pyrimidine-2,4,6-triamine CAS Name: N4-(4-bromophenyl)-N4-butyl-5-nitrosopyrimidine-2,4,6-triamine IUPAC Name: 4-N-(4-bromophenyl)-4-N-butyl-5-nitrosopyrimidine-2,4,6-triamine Traditional Name: (4-bromophenyl)-butyl-(2,6-diamino-5-nitroso-pyrimidin-4-yl)amine Formula: C14H17BrN6O MolecularWeight: 365.22838

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN(C1=CC=C(C=C1)Br)C2=NC(=NC(=C2N=O)N)N

Isomeric SMILES

CCCCN(C1=CC=C(C=C1)Br)C2=NC(=NC(=C2N=O)N)N

InChI

InChI=1S/C14H17BrN6O/c1-2-3-8-21(10-6-4-9(15)5-7-10)13-11(20-22)12(16)18-14(17)19-13/h4-7H,2-3,8H2,1H3,(H4,16,17,18,19)