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

Systemtic Name: 3-[2-[(1R)-6,7-dimethoxy-1-phenyl-3,4-dihydro-1H-isoquinolin-2-yl]-2-oxidanylidene-ethyl]-5-thiophen-2-yl-1,3,4-oxadiazol-2-one Openeye Name: 3-[2-[(1R)-6,7-dimethoxy-1-phenyl-3,4-dihydro-1H-isoquinolin-2-yl]-2-oxo-ethyl]-5-(2-thienyl)-1,3,4-oxadiazol-2-one CAS Name: 3-[2-[(1R)-6,7-dimethoxy-1-phenyl-3,4-dihydro-1H-isoquinolin-2-yl]-2-oxoethyl]-5-thiophen-2-yl-1,3,4-oxadiazol-2-one IUPAC Name: 3-[2-[(1R)-6,7-dimethoxy-1-phenyl-3,4-dihydro-1H-isoquinolin-2-yl]-2-oxoethyl]-5-thiophen-2-yl-1,3,4-oxadiazol-2-one Traditional Name: 3-[2-[(1R)-6,7-dimethoxy-1-phenyl-3,4-dihydro-1H-isoquinolin-2-yl]-2-keto-ethyl]-5-(2-thienyl)-1,3,4-oxadiazol-2-one Formula: C25H23N3O5S MolecularWeight: 477.53222

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C(N(CCC2=C1)C(=O)CN3C(=O)OC(=N3)C4=CC=CS4)C5=CC=CC=C5)OC

Isomeric SMILES

COC1=C(C=C2[C@H](N(CCC2=C1)C(=O)CN3C(=O)OC(=N3)C4=CC=CS4)C5=CC=CC=C5)OC

InChI

InChI=1S/C25H23N3O5S/c1-31-19-13-17-10-11-27(23(16-7-4-3-5-8-16)18(17)14-20(19)32-2)22(29)15-28-25(30)33-24(26-28)21-9-6-12-34-21/h3-9,12-14,23H,10-11,15H2,1-2H3/t23-/m1/s1