3-[(4-methyl-1,3-thiazol-2-yl)sulfanylmethyl]-1-benzothiophene-2-carboxylic acid

Systemtic Name: 3-[(4-methyl-1,3-thiazol-2-yl)sulfanylmethyl]-1-benzothiophene-2-carboxylic acid Openeye Name: 3-[(4-methylthiazol-2-yl)sulfanylmethyl]benzothiophene-2-carboxylic acid CAS Name: 3-[[(4-methyl-2-thiazolyl)thio]methyl]-1-benzothiophene-2-carboxylic acid IUPAC Name: 3-[(4-methyl-1,3-thiazol-2-yl)sulfanylmethyl]-1-benzothiophene-2-carboxylic acid Traditional Name: 3-[[(4-methylthiazol-2-yl)thio]methyl]benzothiophene-2-carboxylic acid Formula: C14H11NO2S3 MolecularWeight: 321.43764

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CSC(=N1)SCC2=C(SC3=CC=CC=C32)C(=O)O

Isomeric SMILES

CC1=CSC(=N1)SCC2=C(SC3=CC=CC=C32)C(=O)O

InChI

InChI=1S/C14H11NO2S3/c1-8-6-18-14(15-8)19-7-10-9-4-2-3-5-11(9)20-12(10)13(16)17/h2-6H,7H2,1H3,(H,16,17)