2-[2-hydroxyethyl-(3-methylsulfanyl-4-nitroso-phenyl)amino]ethanol dihydrochloride

Systemtic Name: 2-[2-hydroxyethyl-(3-methylsulfanyl-4-nitroso-phenyl)amino]ethanol dihydrochloride Openeye Name: 2-[N-(2-hydroxyethyl)-3-methylsulfanyl-4-nitroso-anilino]ethanol dihydrochloride CAS Name: 2-[N-(2-hydroxyethyl)-3-(methylthio)-4-nitrosoanilino]ethanol dihydrochloride IUPAC Name: 2-[N-(2-hydroxyethyl)-3-methylsulfanyl-4-nitrosoanilino]ethanol dihydrochloride Traditional Name: 2-[N-(2-hydroxyethyl)-3-(methylthio)-4-nitroso-anilino]ethanol dihydrochloride Formula: C11H18Cl2N2O3S MolecularWeight: 329.24322

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=C(C=CC(=C1)N(CCO)CCO)N=O.Cl.Cl

Isomeric SMILES

CSC1=C(C=CC(=C1)N(CCO)CCO)N=O.Cl.Cl

InChI

InChI=1S/C11H16N2O3S.2ClH/c1-17-11-8-9(2-3-10(11)12-16)13(4-6-14)5-7-15;;/h2-3,8,14-15H,4-7H2,1H3;2*1H