3-[6-(4-ethylphenoxy)pyridin-3-yl]-1-methyl-4-sulfanyl-pyrrolidin-2-one

Systemtic Name: 3-[6-(4-ethylphenoxy)pyridin-3-yl]-1-methyl-4-sulfanyl-pyrrolidin-2-one Openeye Name: 3-[6-(4-ethylphenoxy)-3-pyridyl]-1-methyl-4-sulfanyl-pyrrolidin-2-one CAS Name: 3-[6-(4-ethylphenoxy)-3-pyridinyl]-4-mercapto-1-methyl-2-pyrrolidinone IUPAC Name: 3-[6-(4-ethylphenoxy)pyridin-3-yl]-1-methyl-4-sulfanylpyrrolidin-2-one Traditional Name: 3-[6-(4-ethylphenoxy)-3-pyridyl]-4-mercapto-1-methyl-2-pyrrolidone Formula: C18H20N2O2S MolecularWeight: 328.4286

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)OC2=NC=C(C=C2)C3C(CN(C3=O)C)S

Isomeric SMILES

CCC1=CC=C(C=C1)OC2=NC=C(C=C2)C3C(CN(C3=O)C)S

InChI

InChI=1S/C18H20N2O2S/c1-3-12-4-7-14(8-5-12)22-16-9-6-13(10-19-16)17-15(23)11-20(2)18(17)21/h4-10,15,17,23H,3,11H2,1-2H3