5-[(6,7-dimethoxy-1-thiophen-2-yl-3,4-dihydro-1H-isoquinolin-2-yl)carbonyl]-2-methyl-isoindole-1,3-dione

Systemtic Name: 5-[(6,7-dimethoxy-1-thiophen-2-yl-3,4-dihydro-1H-isoquinolin-2-yl)carbonyl]-2-methyl-isoindole-1,3-dione Openeye Name: 5-[6,7-dimethoxy-1-(2-thienyl)-3,4-dihydro-1H-isoquinoline-2-carbonyl]-2-methyl-isoindoline-1,3-dione CAS Name: 5-[(6,7-dimethoxy-1-thiophen-2-yl-3,4-dihydro-1H-isoquinolin-2-yl)-oxomethyl]-2-methylisoindole-1,3-dione IUPAC Name: 5-(6,7-dimethoxy-1-thiophen-2-yl-3,4-dihydro-1H-isoquinoline-2-carbonyl)-2-methylisoindole-1,3-dione Traditional Name: 5-[6,7-dimethoxy-1-(2-thienyl)-3,4-dihydro-1H-isoquinoline-2-carbonyl]-2-methyl-isoindoline-1,3-quinone Formula: C25H22N2O5S MolecularWeight: 462.51758

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=O)C2=C(C1=O)C=C(C=C2)C(=O)N3CCC4=CC(=C(C=C4C3C5=CC=CS5)OC)OC

Isomeric SMILES

CN1C(=O)C2=C(C1=O)C=C(C=C2)C(=O)N3CCC4=CC(=C(C=C4C3C5=CC=CS5)OC)OC

InChI

InChI=1S/C25H22N2O5S/c1-26-24(29)16-7-6-15(11-18(16)25(26)30)23(28)27-9-8-14-12-19(31-2)20(32-3)13-17(14)22(27)21-5-4-10-33-21/h4-7,10-13,22H,8-9H2,1-3H3