2-(1,3-benzothiazol-2-ylsulfanyl)-6-methoxy-2,3-dihydroinden-1-one

Systemtic Name: 2-(1,3-benzothiazol-2-ylsulfanyl)-6-methoxy-2,3-dihydroinden-1-one Openeye Name: 2-(1,3-benzothiazol-2-ylsulfanyl)-6-methoxy-indan-1-one CAS Name: 2-(1,3-benzothiazol-2-ylthio)-6-methoxy-2,3-dihydroinden-1-one IUPAC Name: 2-(1,3-benzothiazol-2-ylsulfanyl)-6-methoxy-2,3-dihydroinden-1-one Traditional Name: 2-(1,3-benzothiazol-2-ylthio)-6-methoxy-indan-1-one Formula: C17H13NO2S2 MolecularWeight: 327.42062

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(CC(C2=O)SC3=NC4=CC=CC=C4S3)C=C1

Isomeric SMILES

COC1=CC2=C(CC(C2=O)SC3=NC4=CC=CC=C4S3)C=C1

InChI

InChI=1S/C17H13NO2S2/c1-20-11-7-6-10-8-15(16(19)12(10)9-11)22-17-18-13-4-2-3-5-14(13)21-17/h2-7,9,15H,8H2,1H3