ethyl 3-[[2-[(3,4-dimethylphenyl)amino]-2-oxidanylidene-ethyl]sulfanylmethyl]-1-benzofuran-2-carboxylate

Systemtic Name: ethyl 3-[[2-[(3,4-dimethylphenyl)amino]-2-oxidanylidene-ethyl]sulfanylmethyl]-1-benzofuran-2-carboxylate Openeye Name: ethyl 3-[[2-(3,4-dimethylanilino)-2-oxo-ethyl]sulfanylmethyl]benzofuran-2-carboxylate CAS Name: 3-[[[2-(3,4-dimethylanilino)-2-oxoethyl]thio]methyl]-2-benzofurancarboxylic acid ethyl ester IUPAC Name: ethyl 3-[[2-(3,4-dimethylanilino)-2-oxoethyl]sulfanylmethyl]-1-benzofuran-2-carboxylate Traditional Name: 3-[[[2-(3,4-dimethylanilino)-2-keto-ethyl]thio]methyl]coumarilic acid ethyl ester Formula: C22H23NO4S MolecularWeight: 397.48732

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C2=CC=CC=C2O1)CSCC(=O)NC3=CC(=C(C=C3)C)C

Isomeric SMILES

CCOC(=O)C1=C(C2=CC=CC=C2O1)CSCC(=O)NC3=CC(=C(C=C3)C)C

InChI

InChI=1S/C22H23NO4S/c1-4-26-22(25)21-18(17-7-5-6-8-19(17)27-21)12-28-13-20(24)23-16-10-9-14(2)15(3)11-16/h5-11H,4,12-13H2,1-3H3,(H,23,24)