3-(1H-benzimidazol-2-yl)-1-(6,7-dimethoxy-1-thiophen-2-yl-3,4-dihydro-1H-isoquinolin-2-yl)propan-1-one

Systemtic Name: 3-(1H-benzimidazol-2-yl)-1-(6,7-dimethoxy-1-thiophen-2-yl-3,4-dihydro-1H-isoquinolin-2-yl)propan-1-one Openeye Name: 3-(1H-benzimidazol-2-yl)-1-[6,7-dimethoxy-1-(2-thienyl)-3,4-dihydro-1H-isoquinolin-2-yl]propan-1-one CAS Name: 3-(1H-benzimidazol-2-yl)-1-(6,7-dimethoxy-1-thiophen-2-yl-3,4-dihydro-1H-isoquinolin-2-yl)-1-propanone IUPAC Name: 3-(1H-benzimidazol-2-yl)-1-(6,7-dimethoxy-1-thiophen-2-yl-3,4-dihydro-1H-isoquinolin-2-yl)propan-1-one Traditional Name: 3-(1H-benzimidazol-2-yl)-1-[6,7-dimethoxy-1-(2-thienyl)-3,4-dihydro-1H-isoquinolin-2-yl]propan-1-one Formula: C25H25N3O3S MolecularWeight: 447.5493

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C(N(CCC2=C1)C(=O)CCC3=NC4=CC=CC=C4N3)C5=CC=CS5)OC

Isomeric SMILES

COC1=C(C=C2C(N(CCC2=C1)C(=O)CCC3=NC4=CC=CC=C4N3)C5=CC=CS5)OC

InChI

InChI=1S/C25H25N3O3S/c1-30-20-14-16-11-12-28(25(22-8-5-13-32-22)17(16)15-21(20)31-2)24(29)10-9-23-26-18-6-3-4-7-19(18)27-23/h3-8,13-15,25H,9-12H2,1-2H3,(H,26,27)