2-[(1S)-6,7-dimethoxy-1-thiophen-2-yl-3,4-dihydro-1H-isoquinolin-2-yl]-1-(1H-pyrrol-2-yl)ethanone

Systemtic Name: 2-[(1S)-6,7-dimethoxy-1-thiophen-2-yl-3,4-dihydro-1H-isoquinolin-2-yl]-1-(1H-pyrrol-2-yl)ethanone Openeye Name: 2-[(1S)-6,7-dimethoxy-1-(2-thienyl)-3,4-dihydro-1H-isoquinolin-2-yl]-1-(1H-pyrrol-2-yl)ethanone CAS Name: 2-[(1S)-6,7-dimethoxy-1-thiophen-2-yl-3,4-dihydro-1H-isoquinolin-2-yl]-1-(1H-pyrrol-2-yl)ethanone IUPAC Name: 2-[(1S)-6,7-dimethoxy-1-thiophen-2-yl-3,4-dihydro-1H-isoquinolin-2-yl]-1-(1H-pyrrol-2-yl)ethanone Traditional Name: 2-[(1S)-6,7-dimethoxy-1-(2-thienyl)-3,4-dihydro-1H-isoquinolin-2-yl]-1-(1H-pyrrol-2-yl)ethanone Formula: C21H22N2O3S MolecularWeight: 382.47598

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C(N(CCC2=C1)CC(=O)C3=CC=CN3)C4=CC=CS4)OC

Isomeric SMILES

COC1=C(C=C2[C@H](N(CCC2=C1)CC(=O)C3=CC=CN3)C4=CC=CS4)OC

InChI

InChI=1S/C21H22N2O3S/c1-25-18-11-14-7-9-23(13-17(24)16-5-3-8-22-16)21(20-6-4-10-27-20)15(14)12-19(18)26-2/h3-6,8,10-12,21-22H,7,9,13H2,1-2H3/t21-/m0/s1