methyl 4-(oxolan-3-ylmethylcarbamothioylsulfanyl)butanoate

Systemtic Name: methyl 4-(oxolan-3-ylmethylcarbamothioylsulfanyl)butanoate Openeye Name: methyl 4-(tetrahydrofuran-3-ylmethylcarbamothioylsulfanyl)butanoate CAS Name: 4-[[(3-oxolanylmethylamino)-sulfanylidenemethyl]thio]butanoic acid methyl ester IUPAC Name: methyl 4-(oxolan-3-ylmethylcarbamothioylsulfanyl)butanoate Traditional Name: 4-(tetrahydrofuran-3-ylmethylthiocarbamoylthio)butyric acid methyl ester Formula: C11H19NO3S2 MolecularWeight: 277.40346

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CCCSC(=S)NCC1CCOC1

Isomeric SMILES

COC(=O)CCCSC(=S)NCC1CCOC1

InChI

InChI=1S/C11H19NO3S2/c1-14-10(13)3-2-6-17-11(16)12-7-9-4-5-15-8-9/h9H,2-8H2,1H3,(H,12,16)