2-[(2,5-dimethylfuran-3-yl)formamido]-4-(methylsulfanyl)butanoic acid

CAS: 318466-02-3

Formula: C12H17NO4S

SMILES: CSCCC(NC(=O)C1=C(C)OC(C)=C1)C(O)=O

IUPAC: 2-[(2,5-dimethylfuran-3-yl)formamido]-4-(methylsulfanyl)butanoic acid

InChI: InChI=1/C12H17NO4S/c1-7-6-9(8(2)17-7)11(14)13-10(12(15)16)4-5-18-3/h6,10H,4-5H2,1-3H3,(H,13,14)(H,15,16)

Composition: C (53.12%), H (6.32%), N (5.16%), O (23.59%), S (11.82%)

Molar Mass: 271.33

Atom Count: 35

Heavy Atom Count: 18