2-[[3-(1,3-benzothiazol-2-ylsulfanylmethyl)-4-methoxy-phenyl]methylidene]-3,4-dihydronaphthalen-1-one

Systemtic Name: 2-[[3-(1,3-benzothiazol-2-ylsulfanylmethyl)-4-methoxy-phenyl]methylidene]-3,4-dihydronaphthalen-1-one Openeye Name: 2-[[3-(1,3-benzothiazol-2-ylsulfanylmethyl)-4-methoxy-phenyl]methylene]tetralin-1-one CAS Name: 2-[[3-[(1,3-benzothiazol-2-ylthio)methyl]-4-methoxyphenyl]methylidene]-3,4-dihydronaphthalen-1-one IUPAC Name: 2-[[3-(1,3-benzothiazol-2-ylsulfanylmethyl)-4-methoxyphenyl]methylidene]-3,4-dihydronaphthalen-1-one Traditional Name: 2-[3-[(1,3-benzothiazol-2-ylthio)methyl]-4-methoxy-benzylidene]tetralin-1-one Formula: C26H21NO2S2 MolecularWeight: 443.58044

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C=C2CCC3=CC=CC=C3C2=O)CSC4=NC5=CC=CC=C5S4

Isomeric SMILES

COC1=C(C=C(C=C1)C=C2CCC3=CC=CC=C3C2=O)CSC4=NC5=CC=CC=C5S4

InChI

InChI=1S/C26H21NO2S2/c1-29-23-13-10-17(14-19-12-11-18-6-2-3-7-21(18)25(19)28)15-20(23)16-30-26-27-22-8-4-5-9-24(22)31-26/h2-10,13-15H,11-12,16H2,1H3