5-[[4-[2-(5-ethylpyridin-2-yl)ethoxy]phenyl]methyl]thiolane-2,4-dione

Systemtic Name: 5-[[4-[2-(5-ethylpyridin-2-yl)ethoxy]phenyl]methyl]thiolane-2,4-dione Openeye Name: 5-[[4-[2-(5-ethyl-2-pyridyl)ethoxy]phenyl]methyl]tetrahydrothiophene-2,4-dione CAS Name: 5-[[4-[2-(5-ethyl-2-pyridinyl)ethoxy]phenyl]methyl]thiolane-2,4-dione IUPAC Name: 5-[[4-[2-(5-ethylpyridin-2-yl)ethoxy]phenyl]methyl]thiolane-2,4-dione Traditional Name: 5-[4-[2-(5-ethyl-2-pyridyl)ethoxy]benzyl]tetrahydrothiophene-2,4-quinone Formula: C20H21NO3S MolecularWeight: 355.45064

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=CN=C(C=C1)CCOC2=CC=C(C=C2)CC3C(=O)CC(=O)S3

Isomeric SMILES

CCC1=CN=C(C=C1)CCOC2=CC=C(C=C2)CC3C(=O)CC(=O)S3

InChI

InChI=1S/C20H21NO3S/c1-2-14-3-6-16(21-13-14)9-10-24-17-7-4-15(5-8-17)11-19-18(22)12-20(23)25-19/h3-8,13,19H,2,9-12H2,1H3