N-(4-chloranyl-2-fluoranyl-phenyl)-2-[(1S)-6,7-dimethoxy-1-thiophen-2-yl-3,4-dihydro-1H-isoquinolin-2-yl]ethanamide

Systemtic Name: N-(4-chloranyl-2-fluoranyl-phenyl)-2-[(1S)-6,7-dimethoxy-1-thiophen-2-yl-3,4-dihydro-1H-isoquinolin-2-yl]ethanamide Openeye Name: N-(4-chloro-2-fluoro-phenyl)-2-[(1S)-6,7-dimethoxy-1-(2-thienyl)-3,4-dihydro-1H-isoquinolin-2-yl]acetamide CAS Name: N-(4-chloro-2-fluorophenyl)-2-[(1S)-6,7-dimethoxy-1-thiophen-2-yl-3,4-dihydro-1H-isoquinolin-2-yl]acetamide IUPAC Name: N-(4-chloro-2-fluorophenyl)-2-[(1S)-6,7-dimethoxy-1-thiophen-2-yl-3,4-dihydro-1H-isoquinolin-2-yl]acetamide Traditional Name: N-(4-chloro-2-fluoro-phenyl)-2-[(1S)-6,7-dimethoxy-1-(2-thienyl)-3,4-dihydro-1H-isoquinolin-2-yl]acetamide Formula: C23H22ClFN2O3S MolecularWeight: 460.948783

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C(N(CCC2=C1)CC(=O)NC3=C(C=C(C=C3)Cl)F)C4=CC=CS4)OC

Isomeric SMILES

COC1=C(C=C2[C@H](N(CCC2=C1)CC(=O)NC3=C(C=C(C=C3)Cl)F)C4=CC=CS4)OC

InChI

InChI=1S/C23H22ClFN2O3S/c1-29-19-10-14-7-8-27(13-22(28)26-18-6-5-15(24)11-17(18)25)23(21-4-3-9-31-21)16(14)12-20(19)30-2/h3-6,9-12,23H,7-8,13H2,1-2H3,(H,26,28)/t23-/m0/s1