5-[(4-acetamidophenyl)sulfanylmethyl]-2-methyl-furan-3-carboxylic acid

Systemtic Name: 5-[(4-acetamidophenyl)sulfanylmethyl]-2-methyl-furan-3-carboxylic acid Openeye Name: 5-[(4-acetamidophenyl)sulfanylmethyl]-2-methyl-furan-3-carboxylic acid CAS Name: 5-[[(4-acetamidophenyl)thio]methyl]-2-methyl-3-furancarboxylic acid IUPAC Name: 5-[(4-acetamidophenyl)sulfanylmethyl]-2-methylfuran-3-carboxylic acid Traditional Name: 5-[[(4-acetamidophenyl)thio]methyl]-2-methyl-3-furoic acid Formula: C15H15NO4S MolecularWeight: 305.3489

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(O1)CSC2=CC=C(C=C2)NC(=O)C)C(=O)O

Isomeric SMILES

CC1=C(C=C(O1)CSC2=CC=C(C=C2)NC(=O)C)C(=O)O

InChI

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