2-[2-[[1-(3-methylpyridin-2-yl)imidazol-2-yl]sulfanylmethyl]phenyl]isoindole-1,3-dione

Systemtic Name: 2-[2-[[1-(3-methylpyridin-2-yl)imidazol-2-yl]sulfanylmethyl]phenyl]isoindole-1,3-dione Openeye Name: 2-[2-[[1-(3-methyl-2-pyridyl)imidazol-2-yl]sulfanylmethyl]phenyl]isoindoline-1,3-dione CAS Name: 2-[2-[[[1-(3-methyl-2-pyridinyl)-2-imidazolyl]thio]methyl]phenyl]isoindole-1,3-dione IUPAC Name: 2-[2-[[1-(3-methylpyridin-2-yl)imidazol-2-yl]sulfanylmethyl]phenyl]isoindole-1,3-dione Traditional Name: 2-[2-[[[1-(3-methyl-2-pyridyl)imidazol-2-yl]thio]methyl]phenyl]isoindoline-1,3-quinone Formula: C24H18N4O2S MolecularWeight: 426.49032

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N=CC=C1)N2C=CN=C2SCC3=CC=CC=C3N4C(=O)C5=CC=CC=C5C4=O

Isomeric SMILES

CC1=C(N=CC=C1)N2C=CN=C2SCC3=CC=CC=C3N4C(=O)C5=CC=CC=C5C4=O

InChI

InChI=1S/C24H18N4O2S/c1-16-7-6-12-25-21(16)27-14-13-26-24(27)31-15-17-8-2-5-11-20(17)28-22(29)18-9-3-4-10-19(18)23(28)30/h2-14H,15H2,1H3