3-[[(1S)-6,7-dimethoxy-1-thiophen-2-yl-3,4-dihydro-1H-isoquinolin-2-yl]carbonyl]-1-ethyl-7-methyl-1,8-naphthyridin-4-one

Systemtic Name: 3-[[(1S)-6,7-dimethoxy-1-thiophen-2-yl-3,4-dihydro-1H-isoquinolin-2-yl]carbonyl]-1-ethyl-7-methyl-1,8-naphthyridin-4-one Openeye Name: 3-[(1S)-6,7-dimethoxy-1-(2-thienyl)-3,4-dihydro-1H-isoquinoline-2-carbonyl]-1-ethyl-7-methyl-1,8-naphthyridin-4-one CAS Name: 3-[[(1S)-6,7-dimethoxy-1-thiophen-2-yl-3,4-dihydro-1H-isoquinolin-2-yl]-oxomethyl]-1-ethyl-7-methyl-1,8-naphthyridin-4-one IUPAC Name: 3-[(1S)-6,7-dimethoxy-1-thiophen-2-yl-3,4-dihydro-1H-isoquinoline-2-carbonyl]-1-ethyl-7-methyl-1,8-naphthyridin-4-one Traditional Name: 3-[(1S)-6,7-dimethoxy-1-(2-thienyl)-3,4-dihydro-1H-isoquinoline-2-carbonyl]-1-ethyl-7-methyl-1,8-naphthyridin-4-one Formula: C27H27N3O4S MolecularWeight: 489.58598

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C=C(C(=O)C2=C1N=C(C=C2)C)C(=O)N3CCC4=CC(=C(C=C4C3C5=CC=CS5)OC)OC

Isomeric SMILES

CCN1C=C(C(=O)C2=C1N=C(C=C2)C)C(=O)N3CCC4=CC(=C(C=C4[C@H]3C5=CC=CS5)OC)OC

InChI

InChI=1S/C27H27N3O4S/c1-5-29-15-20(25(31)18-9-8-16(2)28-26(18)29)27(32)30-11-10-17-13-21(33-3)22(34-4)14-19(17)24(30)23-7-6-12-35-23/h6-9,12-15,24H,5,10-11H2,1-4H3/t24-/m0/s1