2-[(2-methylphenyl)-[5-(methylsulfanylmethyl)furan-2-yl]amino]ethanoic acid

Systemtic Name: 2-[(2-methylphenyl)-[5-(methylsulfanylmethyl)furan-2-yl]amino]ethanoic acid Openeye Name: 2-(2-methyl-N-[5-(methylsulfanylmethyl)-2-furyl]anilino)acetic acid CAS Name: 2-(2-methyl-N-[5-[(methylthio)methyl]-2-furanyl]anilino)acetic acid IUPAC Name: 2-(2-methyl-N-[5-(methylsulfanylmethyl)furan-2-yl]anilino)acetic acid Traditional Name: 2-(2-methyl-N-[5-[(methylthio)methyl]-2-furyl]anilino)acetic acid Formula: C15H17NO3S MolecularWeight: 291.36538

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1N(CC(=O)O)C2=CC=C(O2)CSC

Isomeric SMILES

CC1=CC=CC=C1N(CC(=O)O)C2=CC=C(O2)CSC

InChI

InChI=1S/C15H17NO3S/c1-11-5-3-4-6-13(11)16(9-15(17)18)14-8-7-12(19-14)10-20-2/h3-8H,9-10H2,1-2H3,(H,17,18)