(4-methyl-2-propanoyl-phenyl) 3-[(4-methyl-1,3-thiazol-2-yl)sulfanylmethyl]-1-benzofuran-2-carboxylate

Systemtic Name: (4-methyl-2-propanoyl-phenyl) 3-[(4-methyl-1,3-thiazol-2-yl)sulfanylmethyl]-1-benzofuran-2-carboxylate Openeye Name: (4-methyl-2-propanoyl-phenyl) 3-[(4-methylthiazol-2-yl)sulfanylmethyl]benzofuran-2-carboxylate CAS Name: 3-[[(4-methyl-2-thiazolyl)thio]methyl]-2-benzofurancarboxylic acid [4-methyl-2-(1-oxopropyl)phenyl] ester IUPAC Name: (4-methyl-2-propanoylphenyl) 3-[(4-methyl-1,3-thiazol-2-yl)sulfanylmethyl]-1-benzofuran-2-carboxylate Traditional Name: 3-[[(4-methylthiazol-2-yl)thio]methyl]coumarilic acid (4-methyl-2-propionyl-phenyl) ester Formula: C24H21NO4S2 MolecularWeight: 451.55784

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)C1=C(C=CC(=C1)C)OC(=O)C2=C(C3=CC=CC=C3O2)CSC4=NC(=CS4)C

Isomeric SMILES

CCC(=O)C1=C(C=CC(=C1)C)OC(=O)C2=C(C3=CC=CC=C3O2)CSC4=NC(=CS4)C

InChI

InChI=1S/C24H21NO4S2/c1-4-19(26)17-11-14(2)9-10-21(17)29-23(27)22-18(13-31-24-25-15(3)12-30-24)16-7-5-6-8-20(16)28-22/h5-12H,4,13H2,1-3H3