6-ethyl-3-methyl-N-(2-methylsulfanylphenyl)-1-oxidanylidene-4H-isochromene-3-carboxamide

Systemtic Name: 6-ethyl-3-methyl-N-(2-methylsulfanylphenyl)-1-oxidanylidene-4H-isochromene-3-carboxamide Openeye Name: 6-ethyl-3-methyl-N-(2-methylsulfanylphenyl)-1-oxo-isochromane-3-carboxamide CAS Name: 6-ethyl-3-methyl-N-[2-(methylthio)phenyl]-1-oxo-3,4-dihydro-1H-2-benzopyran-3-carboxamide IUPAC Name: 6-ethyl-3-methyl-N-(2-methylsulfanylphenyl)-1-oxo-4H-isochromene-3-carboxamide Traditional Name: 6-ethyl-1-keto-3-methyl-N-[2-(methylthio)phenyl]isochroman-3-carboxamide Formula: C20H21NO3S MolecularWeight: 355.45064

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC2=C(C=C1)C(=O)OC(C2)(C)C(=O)NC3=CC=CC=C3SC

Isomeric SMILES

CCC1=CC2=C(C=C1)C(=O)OC(C2)(C)C(=O)NC3=CC=CC=C3SC

InChI

InChI=1S/C20H21NO3S/c1-4-13-9-10-15-14(11-13)12-20(2,24-18(15)22)19(23)21-16-7-5-6-8-17(16)25-3/h5-11H,4,12H2,1-3H3,(H,21,23)