N-(3-chloranyl-4-fluoranyl-phenyl)-6,7-dimethoxy-2-methyl-1-oxidanylidene-3-thiophen-2-yl-3,4-dihydroisoquinoline-4-carboxamide

Systemtic Name: N-(3-chloranyl-4-fluoranyl-phenyl)-6,7-dimethoxy-2-methyl-1-oxidanylidene-3-thiophen-2-yl-3,4-dihydroisoquinoline-4-carboxamide Openeye Name: N-(3-chloro-4-fluoro-phenyl)-6,7-dimethoxy-2-methyl-1-oxo-3-(2-thienyl)-3,4-dihydroisoquinoline-4-carboxamide CAS Name: N-(3-chloro-4-fluorophenyl)-6,7-dimethoxy-2-methyl-1-oxo-3-thiophen-2-yl-3,4-dihydroisoquinoline-4-carboxamide IUPAC Name: N-(3-chloro-4-fluorophenyl)-6,7-dimethoxy-2-methyl-1-oxo-3-thiophen-2-yl-3,4-dihydroisoquinoline-4-carboxamide Traditional Name: N-(3-chloro-4-fluoro-phenyl)-1-keto-6,7-dimethoxy-2-methyl-3-(2-thienyl)-3,4-dihydroisoquinoline-4-carboxamide Formula: C23H20ClFN2O4S MolecularWeight: 474.932303

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(C(C2=CC(=C(C=C2C1=O)OC)OC)C(=O)NC3=CC(=C(C=C3)F)Cl)C4=CC=CS4

Isomeric SMILES

CN1C(C(C2=CC(=C(C=C2C1=O)OC)OC)C(=O)NC3=CC(=C(C=C3)F)Cl)C4=CC=CS4

InChI

InChI=1S/C23H20ClFN2O4S/c1-27-21(19-5-4-8-32-19)20(22(28)26-12-6-7-16(25)15(24)9-12)13-10-17(30-2)18(31-3)11-14(13)23(27)29/h4-11,20-21H,1-3H3,(H,26,28)