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

Systemtic Name: 6,7-dimethoxy-2-methyl-3-(4-methylsulfanylphenyl)-1-oxidanylidene-N-[4-(trifluoromethyl)phenyl]-3,4-dihydroisoquinoline-4-carboxamide Openeye Name: 6,7-dimethoxy-2-methyl-3-(4-methylsulfanylphenyl)-1-oxo-N-[4-(trifluoromethyl)phenyl]-3,4-dihydroisoquinoline-4-carboxamide CAS Name: 6,7-dimethoxy-2-methyl-3-[4-(methylthio)phenyl]-1-oxo-N-[4-(trifluoromethyl)phenyl]-3,4-dihydroisoquinoline-4-carboxamide IUPAC Name: 6,7-dimethoxy-2-methyl-3-(4-methylsulfanylphenyl)-1-oxo-N-[4-(trifluoromethyl)phenyl]-3,4-dihydroisoquinoline-4-carboxamide Traditional Name: 1-keto-6,7-dimethoxy-2-methyl-3-[4-(methylthio)phenyl]-N-[4-(trifluoromethyl)phenyl]-3,4-dihydroisoquinoline-4-carboxamide Formula: C27H25F3N2O4S MolecularWeight: 530.55861

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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)C(F)(F)F)C4=CC=C(C=C4)SC

Isomeric SMILES

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

InChI

InChI=1S/C27H25F3N2O4S/c1-32-24(15-5-11-18(37-4)12-6-15)23(19-13-21(35-2)22(36-3)14-20(19)26(32)34)25(33)31-17-9-7-16(8-10-17)27(28,29)30/h5-14,23-24H,1-4H3,(H,31,33)