ethyl 2-[[3-oxidanylidene-2-(thiophen-2-ylmethyl)-1H-isoindol-1-yl]sulfanyl]ethanoate

Systemtic Name: ethyl 2-[[3-oxidanylidene-2-(thiophen-2-ylmethyl)-1H-isoindol-1-yl]sulfanyl]ethanoate Openeye Name: ethyl 2-[3-oxo-2-(2-thienylmethyl)isoindolin-1-yl]sulfanylacetate CAS Name: 2-[[3-oxo-2-(thiophen-2-ylmethyl)-1H-isoindol-1-yl]thio]acetic acid ethyl ester IUPAC Name: ethyl 2-[[3-oxo-2-(thiophen-2-ylmethyl)-1H-isoindol-1-yl]sulfanyl]acetate Traditional Name: 2-[[3-keto-2-(2-thenyl)isoindolin-1-yl]thio]acetic acid ethyl ester Formula: C17H17NO3S2 MolecularWeight: 347.45178

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CSC1C2=CC=CC=C2C(=O)N1CC3=CC=CS3

Isomeric SMILES

CCOC(=O)CSC1C2=CC=CC=C2C(=O)N1CC3=CC=CS3

InChI

InChI=1S/C17H17NO3S2/c1-2-21-15(19)11-23-17-14-8-4-3-7-13(14)16(20)18(17)10-12-6-5-9-22-12/h3-9,17H,2,10-11H2,1H3