2-[[3-oxidanylidene-2-(thiophen-3-ylmethyl)-1H-isoindol-1-yl]sulfanyl]ethanoic acid

Systemtic Name: 2-[[3-oxidanylidene-2-(thiophen-3-ylmethyl)-1H-isoindol-1-yl]sulfanyl]ethanoic acid Openeye Name: 2-[3-oxo-2-(3-thienylmethyl)isoindolin-1-yl]sulfanylacetic acid CAS Name: 2-[[3-oxo-2-(3-thiophenylmethyl)-1H-isoindol-1-yl]thio]acetic acid IUPAC Name: 2-[[3-oxo-2-(thiophen-3-ylmethyl)-1H-isoindol-1-yl]sulfanyl]acetic acid Traditional Name: 2-[[3-keto-2-(3-thenyl)isoindolin-1-yl]thio]acetic acid Formula: C15H13NO3S2 MolecularWeight: 319.39862

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(N(C2=O)CC3=CSC=C3)SCC(=O)O

Isomeric SMILES

C1=CC=C2C(=C1)C(N(C2=O)CC3=CSC=C3)SCC(=O)O

InChI

InChI=1S/C15H13NO3S2/c17-13(18)9-21-15-12-4-2-1-3-11(12)14(19)16(15)7-10-5-6-20-8-10/h1-6,8,15H,7,9H2,(H,17,18)