6,7-dimethoxy-2-methyl-3-(4-methylsulfanylphenyl)-1-oxidanylidene-N-(oxolan-2-ylmethyl)-3,4-dihydroisoquinoline-4-carboxamide

Systemtic Name: 6,7-dimethoxy-2-methyl-3-(4-methylsulfanylphenyl)-1-oxidanylidene-N-(oxolan-2-ylmethyl)-3,4-dihydroisoquinoline-4-carboxamide Openeye Name: 6,7-dimethoxy-2-methyl-3-(4-methylsulfanylphenyl)-1-oxo-N-(tetrahydrofuran-2-ylmethyl)-3,4-dihydroisoquinoline-4-carboxamide CAS Name: 6,7-dimethoxy-2-methyl-3-[4-(methylthio)phenyl]-1-oxo-N-(2-oxolanylmethyl)-3,4-dihydroisoquinoline-4-carboxamide IUPAC Name: 6,7-dimethoxy-2-methyl-3-(4-methylsulfanylphenyl)-1-oxo-N-(oxolan-2-ylmethyl)-3,4-dihydroisoquinoline-4-carboxamide Traditional Name: 1-keto-6,7-dimethoxy-2-methyl-3-[4-(methylthio)phenyl]-N-(tetrahydrofurfuryl)-3,4-dihydroisoquinoline-4-carboxamide Formula: C25H30N2O5S MolecularWeight: 470.5811

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(C(C2=CC(=C(C=C2C1=O)OC)OC)C(=O)NCC3CCCO3)C4=CC=C(C=C4)SC

Isomeric SMILES

CN1C(C(C2=CC(=C(C=C2C1=O)OC)OC)C(=O)NCC3CCCO3)C4=CC=C(C=C4)SC

InChI

InChI=1S/C25H30N2O5S/c1-27-23(15-7-9-17(33-4)10-8-15)22(24(28)26-14-16-6-5-11-32-16)18-12-20(30-2)21(31-3)13-19(18)25(27)29/h7-10,12-13,16,22-23H,5-6,11,14H2,1-4H3,(H,26,28)