4-methyl-2-[[5-(methylsulfanylmethyl)furan-2-yl]carbonylamino]pentanoic acid

Systemtic Name: 4-methyl-2-[[5-(methylsulfanylmethyl)furan-2-yl]carbonylamino]pentanoic acid Openeye Name: 4-methyl-2-[[5-(methylsulfanylmethyl)furan-2-carbonyl]amino]pentanoic acid CAS Name: 4-methyl-2-[[[5-[(methylthio)methyl]-2-furanyl]-oxomethyl]amino]pentanoic acid IUPAC Name: 4-methyl-2-[[5-(methylsulfanylmethyl)furan-2-carbonyl]amino]pentanoic acid Traditional Name: 4-methyl-2-[[5-[(methylthio)methyl]-2-furoyl]amino]valeric acid Formula: C13H19NO4S MolecularWeight: 285.35926

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C(=O)O)NC(=O)C1=CC=C(O1)CSC

Isomeric SMILES

CC(C)CC(C(=O)O)NC(=O)C1=CC=C(O1)CSC

InChI

InChI=1S/C13H19NO4S/c1-8(2)6-10(13(16)17)14-12(15)11-5-4-9(18-11)7-19-3/h4-5,8,10H,6-7H2,1-3H3,(H,14,15)(H,16,17)