3-[2-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)-2-oxidanylidene-ethyl]-5-thiophen-2-yl-1,3,4-oxadiazol-2-one

Systemtic Name: 3-[2-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)-2-oxidanylidene-ethyl]-5-thiophen-2-yl-1,3,4-oxadiazol-2-one Openeye Name: 3-[2-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)-2-oxo-ethyl]-5-(2-thienyl)-1,3,4-oxadiazol-2-one CAS Name: 3-[2-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)-2-oxoethyl]-5-thiophen-2-yl-1,3,4-oxadiazol-2-one IUPAC Name: 3-[2-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)-2-oxoethyl]-5-thiophen-2-yl-1,3,4-oxadiazol-2-one Traditional Name: 3-[2-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)-2-keto-ethyl]-5-(2-thienyl)-1,3,4-oxadiazol-2-one Formula: C19H19N3O5S MolecularWeight: 401.43626

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2CN(CCC2=C1)C(=O)CN3C(=O)OC(=N3)C4=CC=CS4)OC

Isomeric SMILES

COC1=C(C=C2CN(CCC2=C1)C(=O)CN3C(=O)OC(=N3)C4=CC=CS4)OC

InChI

InChI=1S/C19H19N3O5S/c1-25-14-8-12-5-6-21(10-13(12)9-15(14)26-2)17(23)11-22-19(24)27-18(20-22)16-4-3-7-28-16/h3-4,7-9H,5-6,10-11H2,1-2H3