methyl 3-(butan-2-ylcarbamothioylsulfanyl)propanoate

Systemtic Name: methyl 3-(butan-2-ylcarbamothioylsulfanyl)propanoate Openeye Name: methyl 3-(sec-butylcarbamothioylsulfanyl)propanoate CAS Name: 3-[[(butan-2-ylamino)-sulfanylidenemethyl]thio]propanoic acid methyl ester IUPAC Name: methyl 3-(butan-2-ylcarbamothioylsulfanyl)propanoate Traditional Name: 3-(sec-butylthiocarbamoylthio)propionic acid methyl ester Formula: C9H17NO2S2 MolecularWeight: 235.36678

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)NC(=S)SCCC(=O)OC

Isomeric SMILES

CCC(C)NC(=S)SCCC(=O)OC

InChI

InChI=1S/C9H17NO2S2/c1-4-7(2)10-9(13)14-6-5-8(11)12-3/h7H,4-6H2,1-3H3,(H,10,13)