4-[butan-2-yl(2-sulfanylethyl)carbamoyl]oxy-3-methyl-butanedithioic acid

Systemtic Name: 4-[butan-2-yl(2-sulfanylethyl)carbamoyl]oxy-3-methyl-butanedithioic acid Openeye Name: 3-methyl-4-[sec-butyl(2-sulfanylethyl)carbamoyl]oxy-butanedithioic acid CAS Name: 4-[[butan-2-yl(2-mercaptoethyl)amino]-oxomethoxy]-3-methylbutanedithioic acid IUPAC Name: 4-[butan-2-yl(2-sulfanylethyl)carbamoyl]oxy-3-methylbutanedithioic acid Traditional Name: 4-[2-mercaptoethyl(sec-butyl)carbamoyl]oxy-3-methyl-butanedithioic acid Formula: C12H23NO2S3 MolecularWeight: 309.51152

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)N(CCS)C(=O)OCC(C)CC(=S)S

Isomeric SMILES

CCC(C)N(CCS)C(=O)OCC(C)CC(=S)S

InChI

InChI=1S/C12H23NO2S3/c1-4-10(3)13(5-6-16)12(14)15-8-9(2)7-11(17)18/h9-10,16H,4-8H2,1-3H3,(H,17,18)