N-[(4-fluorophenyl)methyl]-6,7-dimethoxy-2-methyl-3-(4-methylsulfanylphenyl)-1-oxidanylidene-3,4-dihydroisoquinoline-4-carboxamide

Systemtic Name: N-[(4-fluorophenyl)methyl]-6,7-dimethoxy-2-methyl-3-(4-methylsulfanylphenyl)-1-oxidanylidene-3,4-dihydroisoquinoline-4-carboxamide Openeye Name: N-[(4-fluorophenyl)methyl]-6,7-dimethoxy-2-methyl-3-(4-methylsulfanylphenyl)-1-oxo-3,4-dihydroisoquinoline-4-carboxamide CAS Name: N-[(4-fluorophenyl)methyl]-6,7-dimethoxy-2-methyl-3-[4-(methylthio)phenyl]-1-oxo-3,4-dihydroisoquinoline-4-carboxamide IUPAC Name: N-[(4-fluorophenyl)methyl]-6,7-dimethoxy-2-methyl-3-(4-methylsulfanylphenyl)-1-oxo-3,4-dihydroisoquinoline-4-carboxamide Traditional Name: N-(4-fluorobenzyl)-1-keto-6,7-dimethoxy-2-methyl-3-[4-(methylthio)phenyl]-3,4-dihydroisoquinoline-4-carboxamide Formula: C27H27FN2O4S MolecularWeight: 494.577683

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(C(C2=CC(=C(C=C2C1=O)OC)OC)C(=O)NCC3=CC=C(C=C3)F)C4=CC=C(C=C4)SC

Isomeric SMILES

CN1C(C(C2=CC(=C(C=C2C1=O)OC)OC)C(=O)NCC3=CC=C(C=C3)F)C4=CC=C(C=C4)SC

InChI

InChI=1S/C27H27FN2O4S/c1-30-25(17-7-11-19(35-4)12-8-17)24(26(31)29-15-16-5-9-18(28)10-6-16)20-13-22(33-2)23(34-3)14-21(20)27(30)32/h5-14,24-25H,15H2,1-4H3,(H,29,31)