ethyl 8,9-dimethoxy-3-methyl-2-(4-methylsulfanylphenyl)-5,6-dihydropyrrolo[2,1-a]isoquinoline-1-carboxylate

Systemtic Name: ethyl 8,9-dimethoxy-3-methyl-2-(4-methylsulfanylphenyl)-5,6-dihydropyrrolo[2,1-a]isoquinoline-1-carboxylate Openeye Name: ethyl 8,9-dimethoxy-3-methyl-2-(4-methylsulfanylphenyl)-5,6-dihydropyrrolo[2,1-a]isoquinoline-1-carboxylate CAS Name: 8,9-dimethoxy-3-methyl-2-[4-(methylthio)phenyl]-5,6-dihydropyrrolo[2,1-a]isoquinoline-1-carboxylic acid ethyl ester IUPAC Name: ethyl 8,9-dimethoxy-3-methyl-2-(4-methylsulfanylphenyl)-5,6-dihydropyrrolo[2,1-a]isoquinoline-1-carboxylate Traditional Name: 8,9-dimethoxy-3-methyl-2-[4-(methylthio)phenyl]-5,6-dihydropyrrol[2,1-a]isoquinoline-1-carboxylic acid ethyl ester Formula: C25H27NO4S MolecularWeight: 437.55118

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C2C3=CC(=C(C=C3CCN2C(=C1C4=CC=C(C=C4)SC)C)OC)OC

Isomeric SMILES

CCOC(=O)C1=C2C3=CC(=C(C=C3CCN2C(=C1C4=CC=C(C=C4)SC)C)OC)OC

InChI

InChI=1S/C25H27NO4S/c1-6-30-25(27)23-22(16-7-9-18(31-5)10-8-16)15(2)26-12-11-17-13-20(28-3)21(29-4)14-19(17)24(23)26/h7-10,13-14H,6,11-12H2,1-5H3