6,7-dimethoxy-1-(2-phenyl-1-benzothiophen-3-yl)-1,2,3,4-tetrahydroisoquinoline

Systemtic Name: 6,7-dimethoxy-1-(2-phenyl-1-benzothiophen-3-yl)-1,2,3,4-tetrahydroisoquinoline Openeye Name: 6,7-dimethoxy-1-(2-phenylbenzothiophen-3-yl)-1,2,3,4-tetrahydroisoquinoline CAS Name: 6,7-dimethoxy-1-(2-phenyl-1-benzothiophen-3-yl)-1,2,3,4-tetrahydroisoquinoline IUPAC Name: 6,7-dimethoxy-1-(2-phenyl-1-benzothiophen-3-yl)-1,2,3,4-tetrahydroisoquinoline Traditional Name: 6,7-dimethoxy-1-(2-phenylbenzothiophen-3-yl)-1,2,3,4-tetrahydroisoquinoline Formula: C25H23NO2S MolecularWeight: 401.52062

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C(NCCC2=C1)C3=C(SC4=CC=CC=C43)C5=CC=CC=C5)OC

Isomeric SMILES

COC1=C(C=C2C(NCCC2=C1)C3=C(SC4=CC=CC=C43)C5=CC=CC=C5)OC

InChI

InChI=1S/C25H23NO2S/c1-27-20-14-17-12-13-26-24(19(17)15-21(20)28-2)23-18-10-6-7-11-22(18)29-25(23)16-8-4-3-5-9-16/h3-11,14-15,24,26H,12-13H2,1-2H3