methyl 4-[[(2S,3R,3aR,6S,6aR)-3,6-bis(oxidanyl)-2,3,3a,5,6,6a-hexahydrothieno[3,2-b]furan-2-yl]sulfanyl]benzenecarboximidothioate

Systemtic Name: methyl 4-[[(2S,3R,3aR,6S,6aR)-3,6-bis(oxidanyl)-2,3,3a,5,6,6a-hexahydrothieno[3,2-b]furan-2-yl]sulfanyl]benzenecarboximidothioate Openeye Name: methyl 4-[[(2S,3R,3aR,6S,6aR)-3,6-dihydroxy-2,3,3a,5,6,6a-hexahydrothieno[3,2-b]furan-2-yl]sulfanyl]benzenecarboximidothioate CAS Name: 4-[[(2S,3R,3aR,6S,6aR)-3,6-dihydroxy-2,3,3a,5,6,6a-hexahydrothieno[3,2-b]furan-2-yl]thio]benzenecarboximidothioic acid methyl ester IUPAC Name: methyl 4-[[(2S,3R,3aR,6S,6aR)-3,6-dihydroxy-2,3,3a,5,6,6a-hexahydrothieno[3,2-b]furan-2-yl]sulfanyl]benzenecarboximidothioate Traditional Name: 4-[[(2S,3R,3aR,6S,6aR)-3,6-dihydroxy-2,3,3a,5,6,6a-hexahydrothieno[3,2-b]furan-2-yl]thio]benzenecarboximidothioic acid methyl ester Formula: C14H17NO3S3 MolecularWeight: 343.48468

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CSC(=N)C1=CC=C(C=C1)SC2C(C3C(O2)C(CS3)O)O

Isomeric SMILES

CSC(=N)C1=CC=C(C=C1)S[C@H]2[C@@H]([C@@H]3[C@H](O2)[C@@H](CS3)O)O

InChI

InChI=1S/C14H17NO3S3/c1-19-13(15)7-2-4-8(5-3-7)21-14-10(17)12-11(18-14)9(16)6-20-12/h2-5,9-12,14-17H,6H2,1H3/t9-,10-,11-,12-,14+/m1/s1