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

Systemtic Name: 4-[[[5-(methylsulfanylmethyl)furan-2-yl]carbonylamino]methyl]benzoic acid Openeye Name: 4-[[[5-(methylsulfanylmethyl)furan-2-carbonyl]amino]methyl]benzoic acid CAS Name: 4-[[[[5-[(methylthio)methyl]-2-furanyl]-oxomethyl]amino]methyl]benzoic acid IUPAC Name: 4-[[[5-(methylsulfanylmethyl)furan-2-carbonyl]amino]methyl]benzoic acid Traditional Name: 4-[[[5-[(methylthio)methyl]-2-furoyl]amino]methyl]benzoic acid Formula: C15H15NO4S MolecularWeight: 305.3489

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Descriptors Computed from Structure

Canonical SMILES:

CSCC1=CC=C(O1)C(=O)NCC2=CC=C(C=C2)C(=O)O

Isomeric SMILES

CSCC1=CC=C(O1)C(=O)NCC2=CC=C(C=C2)C(=O)O

InChI

InChI=1S/C15H15NO4S/c1-21-9-12-6-7-13(20-12)14(17)16-8-10-2-4-11(5-3-10)15(18)19/h2-7H,8-9H2,1H3,(H,16,17)(H,18,19)