methyl (2S,3S,10bS)-1-[2-(1H-indol-3-yl)ethyl]-8,9-dimethoxy-2-thiophen-2-yl-3,5,6,10b-tetrahydro-2H-imidazo[2,1-a]isoquinoline-3-carboxylate

Systemtic Name: methyl (2S,3S,10bS)-1-[2-(1H-indol-3-yl)ethyl]-8,9-dimethoxy-2-thiophen-2-yl-3,5,6,10b-tetrahydro-2H-imidazo[2,1-a]isoquinoline-3-carboxylate Openeye Name: methyl (2S,3S,10bS)-1-[2-(1H-indol-3-yl)ethyl]-8,9-dimethoxy-2-(2-thienyl)-3,5,6,10b-tetrahydro-2H-imidazo[2,1-a]isoquinoline-3-carboxylate CAS Name: (2S,3S,10bS)-1-[2-(1H-indol-3-yl)ethyl]-8,9-dimethoxy-2-thiophen-2-yl-3,5,6,10b-tetrahydro-2H-imidazo[2,1-a]isoquinoline-3-carboxylic acid methyl ester IUPAC Name: methyl (2S,3S,10bS)-1-[2-(1H-indol-3-yl)ethyl]-8,9-dimethoxy-2-thiophen-2-yl-3,5,6,10b-tetrahydro-2H-imidazo[2,1-a]isoquinoline-3-carboxylate Traditional Name: (2S,3S,10bS)-1-[2-(1H-indol-3-yl)ethyl]-8,9-dimethoxy-2-(2-thienyl)-3,5,6,10b-tetrahydro-2H-imidaz[2,1-a]isoquinoline-3-carboxylic acid methyl ester Formula: C29H31N3O4S MolecularWeight: 517.63914

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C3N(CCC2=C1)C(C(N3CCC4=CNC5=CC=CC=C54)C6=CC=CS6)C(=O)OC)OC

Isomeric SMILES

COC1=C(C=C2[C@H]3N(CCC2=C1)[C@@H]([C@H](N3CCC4=CNC5=CC=CC=C54)C6=CC=CS6)C(=O)OC)OC

InChI

InChI=1S/C29H31N3O4S/c1-34-23-15-18-10-12-32-27(29(33)36-3)26(25-9-6-14-37-25)31(28(32)21(18)16-24(23)35-2)13-11-19-17-30-22-8-5-4-7-20(19)22/h4-9,14-17,26-28,30H,10-13H2,1-3H3/t26-,27+,28-/m1/s1