2-[1-(2,4-dimethylpyridin-3-yl)sulfanylpropan-2-yl]isoindole-1,3-dione

Systemtic Name: 2-[1-(2,4-dimethylpyridin-3-yl)sulfanylpropan-2-yl]isoindole-1,3-dione Openeye Name: 2-[2-[(2,4-dimethyl-3-pyridyl)sulfanyl]-1-methyl-ethyl]isoindoline-1,3-dione CAS Name: 2-[1-[(2,4-dimethyl-3-pyridinyl)thio]propan-2-yl]isoindole-1,3-dione IUPAC Name: 2-[1-(2,4-dimethylpyridin-3-yl)sulfanylpropan-2-yl]isoindole-1,3-dione Traditional Name: 2-[2-[(2,4-dimethyl-3-pyridyl)thio]-1-methyl-ethyl]isoindoline-1,3-quinone Formula: C18H18N2O2S MolecularWeight: 326.41272

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NC=C1)C)SCC(C)N2C(=O)C3=CC=CC=C3C2=O

Isomeric SMILES

CC1=C(C(=NC=C1)C)SCC(C)N2C(=O)C3=CC=CC=C3C2=O

InChI

InChI=1S/C18H18N2O2S/c1-11-8-9-19-13(3)16(11)23-10-12(2)20-17(21)14-6-4-5-7-15(14)18(20)22/h4-9,12H,10H2,1-3H3