3-[(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)carbonyl]-2-ethyl-6-methyl-1-(thiophen-2-ylmethyl)pyridin-4-one

Systemtic Name: 3-[(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)carbonyl]-2-ethyl-6-methyl-1-(thiophen-2-ylmethyl)pyridin-4-one Openeye Name: 3-(6,7-dimethoxy-3,4-dihydro-1H-isoquinoline-2-carbonyl)-2-ethyl-6-methyl-1-(2-thienylmethyl)pyridin-4-one CAS Name: 3-[(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)-oxomethyl]-2-ethyl-6-methyl-1-(thiophen-2-ylmethyl)-4-pyridinone IUPAC Name: 3-(6,7-dimethoxy-3,4-dihydro-1H-isoquinoline-2-carbonyl)-2-ethyl-6-methyl-1-(thiophen-2-ylmethyl)pyridin-4-one Traditional Name: 3-(6,7-dimethoxy-3,4-dihydro-1H-isoquinoline-2-carbonyl)-2-ethyl-6-methyl-1-(2-thenyl)-4-pyridone Formula: C25H28N2O4S MolecularWeight: 452.56582

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C(=O)C=C(N1CC2=CC=CS2)C)C(=O)N3CCC4=CC(=C(C=C4C3)OC)OC

Isomeric SMILES

CCC1=C(C(=O)C=C(N1CC2=CC=CS2)C)C(=O)N3CCC4=CC(=C(C=C4C3)OC)OC

InChI

InChI=1S/C25H28N2O4S/c1-5-20-24(21(28)11-16(2)27(20)15-19-7-6-10-32-19)25(29)26-9-8-17-12-22(30-3)23(31-4)13-18(17)14-26/h6-7,10-13H,5,8-9,14-15H2,1-4H3