6-[5-methoxy-2-(4-methylsulfanylphenyl)-1-benzothiophen-3-yl]-2,3-dihydro-1,4-benzodioxine

Systemtic Name: 6-[5-methoxy-2-(4-methylsulfanylphenyl)-1-benzothiophen-3-yl]-2,3-dihydro-1,4-benzodioxine Openeye Name: 6-[5-methoxy-2-(4-methylsulfanylphenyl)benzothiophen-3-yl]-2,3-dihydro-1,4-benzodioxine CAS Name: 6-[5-methoxy-2-[4-(methylthio)phenyl]-1-benzothiophen-3-yl]-2,3-dihydro-1,4-benzodioxin IUPAC Name: 6-[5-methoxy-2-(4-methylsulfanylphenyl)-1-benzothiophen-3-yl]-2,3-dihydro-1,4-benzodioxine Traditional Name: 6-[5-methoxy-2-[4-(methylthio)phenyl]benzothiophen-3-yl]-2,3-dihydro-1,4-benzodioxin Formula: C24H20O3S2 MolecularWeight: 420.5438

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)SC(=C2C3=CC4=C(C=C3)OCCO4)C5=CC=C(C=C5)SC

Isomeric SMILES

COC1=CC2=C(C=C1)SC(=C2C3=CC4=C(C=C3)OCCO4)C5=CC=C(C=C5)SC

InChI

InChI=1S/C24H20O3S2/c1-25-17-6-10-22-19(14-17)23(16-5-9-20-21(13-16)27-12-11-26-20)24(29-22)15-3-7-18(28-2)8-4-15/h3-10,13-14H,11-12H2,1-2H3