ethyl 5-(3-methylbutylsulfanylmethyl)furan-2-carboxylate

Systemtic Name: ethyl 5-(3-methylbutylsulfanylmethyl)furan-2-carboxylate Openeye Name: ethyl 5-(isopentylsulfanylmethyl)furan-2-carboxylate CAS Name: 5-[(3-methylbutylthio)methyl]-2-furancarboxylic acid ethyl ester IUPAC Name: ethyl 5-(3-methylbutylsulfanylmethyl)furan-2-carboxylate Traditional Name: 5-[(isoamylthio)methyl]furan-2-carboxylic acid ethyl ester Formula: C13H20O3S MolecularWeight: 256.3611

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(O1)CSCCC(C)C

Isomeric SMILES

CCOC(=O)C1=CC=C(O1)CSCCC(C)C

InChI

InChI=1S/C13H20O3S/c1-4-15-13(14)12-6-5-11(16-12)9-17-8-7-10(2)3/h5-6,10H,4,7-9H2,1-3H3