methyl 4-[[(2R,3S,4R)-3,4-bis(oxidanyl)oxolan-2-yl]methylcarbamothioylsulfanyl]butanoate

Systemtic Name: methyl 4-[[(2R,3S,4R)-3,4-bis(oxidanyl)oxolan-2-yl]methylcarbamothioylsulfanyl]butanoate Openeye Name: methyl 4-[[(2R,3S,4R)-3,4-dihydroxytetrahydrofuran-2-yl]methylcarbamothioylsulfanyl]butanoate CAS Name: 4-[[[[(2R,3S,4R)-3,4-dihydroxy-2-oxolanyl]methylamino]-sulfanylidenemethyl]thio]butanoic acid methyl ester IUPAC Name: methyl 4-[[(2R,3S,4R)-3,4-dihydroxyoxolan-2-yl]methylcarbamothioylsulfanyl]butanoate Traditional Name: 4-[[(2R,3S,4R)-3,4-dihydroxytetrahydrofuran-2-yl]methylthiocarbamoylthio]butyric acid methyl ester Formula: C11H19NO5S2 MolecularWeight: 309.40226

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CCCSC(=S)NCC1C(C(CO1)O)O

Isomeric SMILES

COC(=O)CCCSC(=S)NC[C@@H]1[C@H]([C@@H](CO1)O)O

InChI

InChI=1S/C11H19NO5S2/c1-16-9(14)3-2-4-19-11(18)12-5-8-10(15)7(13)6-17-8/h7-8,10,13,15H,2-6H2,1H3,(H,12,18)/t7-,8-,10+/m1/s1