3-(2-hydroxyethylsulfanyl)-1-(1,3-thiazol-2-yl)-6,7-dihydro-5H-2-benzothiophen-4-one

Systemtic Name: 3-(2-hydroxyethylsulfanyl)-1-(1,3-thiazol-2-yl)-6,7-dihydro-5H-2-benzothiophen-4-one Openeye Name: 3-(2-hydroxyethylsulfanyl)-1-thiazol-2-yl-6,7-dihydro-5H-2-benzothiophen-4-one CAS Name: 3-(2-hydroxyethylthio)-1-(2-thiazolyl)-6,7-dihydro-5H-2-benzothiophen-4-one IUPAC Name: 3-(2-hydroxyethylsulfanyl)-1-(1,3-thiazol-2-yl)-6,7-dihydro-5H-2-benzothiophen-4-one Traditional Name: 3-(2-hydroxyethylthio)-1-thiazol-2-yl-6,7-dihydro-5H-isobenzothiophen-4-one Formula: C13H13NO2S3 MolecularWeight: 311.44282

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2=C(SC(=C2C(=O)C1)SCCO)C3=NC=CS3

Isomeric SMILES

C1CC2=C(SC(=C2C(=O)C1)SCCO)C3=NC=CS3

InChI

InChI=1S/C13H13NO2S3/c15-5-7-18-13-10-8(2-1-3-9(10)16)11(19-13)12-14-4-6-17-12/h4,6,15H,1-3,5,7H2