5-(2-methylpropylsulfanylmethyl)furan-2-carboxylic acid

Systemtic Name: 5-(2-methylpropylsulfanylmethyl)furan-2-carboxylic acid Openeye Name: 5-(isobutylsulfanylmethyl)furan-2-carboxylic acid CAS Name: 5-[(2-methylpropylthio)methyl]-2-furancarboxylic acid IUPAC Name: 5-(2-methylpropylsulfanylmethyl)furan-2-carboxylic acid Traditional Name: 5-[(isobutylthio)methyl]-2-furoic acid Formula: C10H14O3S MolecularWeight: 214.28136

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CSCC1=CC=C(O1)C(=O)O

Isomeric SMILES

CC(C)CSCC1=CC=C(O1)C(=O)O

InChI

InChI=1S/C10H14O3S/c1-7(2)5-14-6-8-3-4-9(13-8)10(11)12/h3-4,7H,5-6H2,1-2H3,(H,11,12)