3-methyl-2-[(2-methylfuran-3-yl)carbonylamino]-3-sulfanyl-butanoic acid

Systemtic Name: 3-methyl-2-[(2-methylfuran-3-yl)carbonylamino]-3-sulfanyl-butanoic acid Openeye Name: 3-methyl-2-[(2-methylfuran-3-carbonyl)amino]-3-sulfanyl-butanoic acid CAS Name: 3-mercapto-3-methyl-2-[[(2-methyl-3-furanyl)-oxomethyl]amino]butanoic acid IUPAC Name: 3-methyl-2-[(2-methylfuran-3-carbonyl)amino]-3-sulfanylbutanoic acid Traditional Name: 3-mercapto-3-methyl-2-[(2-methyl-3-furoyl)amino]butyric acid Formula: C11H15NO4S MolecularWeight: 257.3061

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CO1)C(=O)NC(C(=O)O)C(C)(C)S

Isomeric SMILES

CC1=C(C=CO1)C(=O)NC(C(=O)O)C(C)(C)S

InChI

InChI=1S/C11H15NO4S/c1-6-7(4-5-16-6)9(13)12-8(10(14)15)11(2,3)17/h4-5,8,17H,1-3H3,(H,12,13)(H,14,15)