methyl 4-(furan-2-yl)-2-sulfanyl-butanoate

Systemtic Name: methyl 4-(furan-2-yl)-2-sulfanyl-butanoate Openeye Name: methyl 4-(2-furyl)-2-sulfanyl-butanoate CAS Name: 4-(2-furanyl)-2-mercaptobutanoic acid methyl ester IUPAC Name: methyl 4-(furan-2-yl)-2-sulfanylbutanoate Traditional Name: 4-(2-furyl)-2-mercapto-butyric acid methyl ester Formula: C9H12O3S MolecularWeight: 200.25478

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(CCC1=CC=CO1)S

Isomeric SMILES

COC(=O)C(CCC1=CC=CO1)S

InChI

InChI=1S/C9H12O3S/c1-11-9(10)8(13)5-4-7-3-2-6-12-7/h2-3,6,8,13H,4-5H2,1H3