methyl 3-(butylcarbamothioylsulfanyl)propanoate

Systemtic Name: methyl 3-(butylcarbamothioylsulfanyl)propanoate Openeye Name: methyl 3-(butylcarbamothioylsulfanyl)propanoate CAS Name: 3-[[butylamino(sulfanylidene)methyl]thio]propanoic acid methyl ester IUPAC Name: methyl 3-(butylcarbamothioylsulfanyl)propanoate Traditional Name: 3-(butylthiocarbamoylthio)propionic acid methyl ester Formula: C9H17NO2S2 MolecularWeight: 235.36678

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=S)SCCC(=O)OC

Isomeric SMILES

CCCCNC(=S)SCCC(=O)OC

InChI

InChI=1S/C9H17NO2S2/c1-3-4-6-10-9(13)14-7-5-8(11)12-2/h3-7H2,1-2H3,(H,10,13)