N2-[2-(4-methoxyphenyl)ethyl]-5-nitroso-pyrimidine-2,4,6-triamine

Systemtic Name: N2-[2-(4-methoxyphenyl)ethyl]-5-nitroso-pyrimidine-2,4,6-triamine Openeye Name: N2-[2-(4-methoxyphenyl)ethyl]-5-nitroso-pyrimidine-2,4,6-triamine CAS Name: N2-[2-(4-methoxyphenyl)ethyl]-5-nitrosopyrimidine-2,4,6-triamine IUPAC Name: 2-N-[2-(4-methoxyphenyl)ethyl]-5-nitrosopyrimidine-2,4,6-triamine Traditional Name: (4,6-diamino-5-nitroso-pyrimidin-2-yl)-[2-(4-methoxyphenyl)ethyl]amine Formula: C13H16N6O2 MolecularWeight: 288.30514

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)CCNC2=NC(=C(C(=N2)N)N=O)N

Isomeric SMILES

COC1=CC=C(C=C1)CCNC2=NC(=C(C(=N2)N)N=O)N

InChI

InChI=1S/C13H16N6O2/c1-21-9-4-2-8(3-5-9)6-7-16-13-17-11(14)10(19-20)12(15)18-13/h2-5H,6-7H2,1H3,(H5,14,15,16,17,18)