N-(5-chloranyl-2-cyano-phenyl)-2-[(1S)-6,7-dimethoxy-1-thiophen-2-yl-3,4-dihydro-1H-isoquinolin-2-yl]ethanamide

Systemtic Name: N-(5-chloranyl-2-cyano-phenyl)-2-[(1S)-6,7-dimethoxy-1-thiophen-2-yl-3,4-dihydro-1H-isoquinolin-2-yl]ethanamide Openeye Name: N-(5-chloro-2-cyano-phenyl)-2-[(1S)-6,7-dimethoxy-1-(2-thienyl)-3,4-dihydro-1H-isoquinolin-2-yl]acetamide CAS Name: N-(5-chloro-2-cyanophenyl)-2-[(1S)-6,7-dimethoxy-1-thiophen-2-yl-3,4-dihydro-1H-isoquinolin-2-yl]acetamide IUPAC Name: N-(5-chloro-2-cyanophenyl)-2-[(1S)-6,7-dimethoxy-1-thiophen-2-yl-3,4-dihydro-1H-isoquinolin-2-yl]acetamide Traditional Name: N-(5-chloro-2-cyano-phenyl)-2-[(1S)-6,7-dimethoxy-1-(2-thienyl)-3,4-dihydro-1H-isoquinolin-2-yl]acetamide Formula: C24H22ClN3O3S MolecularWeight: 467.96778

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C24H22ClN3O3S/c1-30-20-10-15-7-8-28(14-23(29)27-19-11-17(25)6-5-16(19)13-26)24(22-4-3-9-32-22)18(15)12-21(20)31-2/h3-6,9-12,24H,7-8,14H2,1-2H3,(H,27,29)/t24-/m0/s1