(4R)-N-(3-chloranyl-4-fluoranyl-phenyl)-5,8-dimethoxy-4-oxidanyl-3,4-dihydro-1H-isoquinoline-2-carbothioamide

Systemtic Name: (4R)-N-(3-chloranyl-4-fluoranyl-phenyl)-5,8-dimethoxy-4-oxidanyl-3,4-dihydro-1H-isoquinoline-2-carbothioamide Openeye Name: (4R)-N-(3-chloro-4-fluoro-phenyl)-4-hydroxy-5,8-dimethoxy-3,4-dihydro-1H-isoquinoline-2-carbothioamide CAS Name: (4R)-N-(3-chloro-4-fluorophenyl)-4-hydroxy-5,8-dimethoxy-3,4-dihydro-1H-isoquinoline-2-carbothioamide IUPAC Name: (4R)-N-(3-chloro-4-fluorophenyl)-4-hydroxy-5,8-dimethoxy-3,4-dihydro-1H-isoquinoline-2-carbothioamide Traditional Name: (4R)-N-(3-chloro-4-fluoro-phenyl)-4-hydroxy-5,8-dimethoxy-3,4-dihydro-1H-isoquinoline-2-carbothioamide Formula: C18H18ClFN2O3S MolecularWeight: 396.863523

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C2CN(CC(C2=C(C=C1)OC)O)C(=S)NC3=CC(=C(C=C3)F)Cl

Isomeric SMILES

COC1=C2CN(C[C@@H](C2=C(C=C1)OC)O)C(=S)NC3=CC(=C(C=C3)F)Cl

InChI

InChI=1S/C18H18ClFN2O3S/c1-24-15-5-6-16(25-2)17-11(15)8-22(9-14(17)23)18(26)21-10-3-4-13(20)12(19)7-10/h3-7,14,23H,8-9H2,1-2H3,(H,21,26)/t14-/m0/s1