3-methyl-2-[[5-(methylsulfanylmethyl)furan-2-yl]carbonylamino]benzoic acid

Systemtic Name: 3-methyl-2-[[5-(methylsulfanylmethyl)furan-2-yl]carbonylamino]benzoic acid Openeye Name: 3-methyl-2-[[5-(methylsulfanylmethyl)furan-2-carbonyl]amino]benzoic acid CAS Name: 3-methyl-2-[[[5-[(methylthio)methyl]-2-furanyl]-oxomethyl]amino]benzoic acid IUPAC Name: 3-methyl-2-[[5-(methylsulfanylmethyl)furan-2-carbonyl]amino]benzoic acid Traditional Name: 3-methyl-2-[[5-[(methylthio)methyl]-2-furoyl]amino]benzoic acid Formula: C15H15NO4S MolecularWeight: 305.3489

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1NC(=O)C2=CC=C(O2)CSC)C(=O)O

Isomeric SMILES

CC1=CC=CC(=C1NC(=O)C2=CC=C(O2)CSC)C(=O)O

InChI

InChI=1S/C15H15NO4S/c1-9-4-3-5-11(15(18)19)13(9)16-14(17)12-7-6-10(20-12)8-21-2/h3-7H,8H2,1-2H3,(H,16,17)(H,18,19)