ethyl 2-[[(1S)-3-oxidanylidene-2-phenethyl-1H-isoindol-1-yl]sulfanyl]ethanoate

Systemtic Name: ethyl 2-[[(1S)-3-oxidanylidene-2-phenethyl-1H-isoindol-1-yl]sulfanyl]ethanoate Openeye Name: ethyl 2-[(1S)-3-oxo-2-phenethyl-isoindolin-1-yl]sulfanylacetate CAS Name: 2-[[(1S)-3-oxo-2-phenethyl-1H-isoindol-1-yl]thio]acetic acid ethyl ester IUPAC Name: ethyl 2-[[(1S)-3-oxo-2-phenethyl-1H-isoindol-1-yl]sulfanyl]acetate Traditional Name: 2-[[(1S)-3-keto-2-phenethyl-isoindolin-1-yl]thio]acetic acid ethyl ester Formula: C20H21NO3S MolecularWeight: 355.45064

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CSC1C2=CC=CC=C2C(=O)N1CCC3=CC=CC=C3

Isomeric SMILES

CCOC(=O)CS[C@H]1C2=CC=CC=C2C(=O)N1CCC3=CC=CC=C3

InChI

InChI=1S/C20H21NO3S/c1-2-24-18(22)14-25-20-17-11-7-6-10-16(17)19(23)21(20)13-12-15-8-4-3-5-9-15/h3-11,20H,2,12-14H2,1H3/t20-/m0/s1