1-methyl-3-[2-(6-methylsulfanylpurin-9-yl)ethyl]-1-nitroso-urea

Systemtic Name: 1-methyl-3-[2-(6-methylsulfanylpurin-9-yl)ethyl]-1-nitroso-urea Openeye Name: 1-methyl-3-[2-(6-methylsulfanylpurin-9-yl)ethyl]-1-nitroso-urea CAS Name: 1-methyl-3-[2-[6-(methylthio)-9-purinyl]ethyl]-1-nitrosourea IUPAC Name: 1-methyl-3-[2-(6-methylsulfanylpurin-9-yl)ethyl]-1-nitrosourea Traditional Name: 1-methyl-3-[2-[6-(methylthio)purin-9-yl]ethyl]-1-nitroso-urea Formula: C10H13N7O2S MolecularWeight: 295.32092

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Descriptors Computed from Structure

Canonical SMILES:

CN(C(=O)NCCN1C=NC2=C1N=CN=C2SC)N=O

Isomeric SMILES

CN(C(=O)NCCN1C=NC2=C1N=CN=C2SC)N=O

InChI

InChI=1S/C10H13N7O2S/c1-16(15-19)10(18)11-3-4-17-6-14-7-8(17)12-5-13-9(7)20-2/h5-6H,3-4H2,1-2H3,(H,11,18)