2-[dideuterio-(3-ethoxy-1,2-thiazol-5-yl)methyl]isoindole-1,3-dione

Systemtic Name: 2-[dideuterio-(3-ethoxy-1,2-thiazol-5-yl)methyl]isoindole-1,3-dione Openeye Name: 2-[dideuterio-(3-ethoxyisothiazol-5-yl)methyl]isoindoline-1,3-dione CAS Name: 2-[dideuterio-(3-ethoxy-5-isothiazolyl)methyl]isoindole-1,3-dione IUPAC Name: 2-[dideuterio-(3-ethoxy-1,2-thiazol-5-yl)methyl]isoindole-1,3-dione Traditional Name: 2-[dideuterio-(3-ethoxyisothiazol-5-yl)methyl]isoindoline-1,3-quinone Formula: C14H12N2O3S MolecularWeight: 290.334004

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=NSC(=C1)CN2C(=O)C3=CC=CC=C3C2=O

Isomeric SMILES

[2H]C([2H])(C1=CC(=NS1)OCC)N2C(=O)C3=CC=CC=C3C2=O

InChI

InChI=1S/C14H12N2O3S/c1-2-19-12-7-9(20-15-12)8-16-13(17)10-5-3-4-6-11(10)14(16)18/h3-7H,2,8H2,1H3/i8D2