6-(cyclohexylmethoxy)-N2-(4-methylsulfanylphenyl)-5-nitroso-pyrimidine-2,4-diamine

Systemtic Name: 6-(cyclohexylmethoxy)-N2-(4-methylsulfanylphenyl)-5-nitroso-pyrimidine-2,4-diamine Openeye Name: 6-(cyclohexylmethoxy)-N2-(4-methylsulfanylphenyl)-5-nitroso-pyrimidine-2,4-diamine CAS Name: 6-(cyclohexylmethoxy)-N2-[4-(methylthio)phenyl]-5-nitrosopyrimidine-2,4-diamine IUPAC Name: 6-(cyclohexylmethoxy)-2-N-(4-methylsulfanylphenyl)-5-nitrosopyrimidine-2,4-diamine Traditional Name: [4-amino-6-(cyclohexylmethoxy)-5-nitroso-pyrimidin-2-yl]-[4-(methylthio)phenyl]amine Formula: C18H23N5O2S MolecularWeight: 373.47252

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC=C(C=C1)NC2=NC(=C(C(=N2)OCC3CCCCC3)N=O)N

Isomeric SMILES

CSC1=CC=C(C=C1)NC2=NC(=C(C(=N2)OCC3CCCCC3)N=O)N

InChI

InChI=1S/C18H23N5O2S/c1-26-14-9-7-13(8-10-14)20-18-21-16(19)15(23-24)17(22-18)25-11-12-5-3-2-4-6-12/h7-10,12H,2-6,11H2,1H3,(H3,19,20,21,22)