2-[2-(1-azanyl-4-phenyl-imidazol-2-yl)sulfanylethyl]isoindole-1,3-dione

Systemtic Name: 2-[2-(1-azanyl-4-phenyl-imidazol-2-yl)sulfanylethyl]isoindole-1,3-dione Openeye Name: 2-[2-(1-amino-4-phenyl-imidazol-2-yl)sulfanylethyl]isoindoline-1,3-dione CAS Name: 2-[2-[(1-amino-4-phenyl-2-imidazolyl)thio]ethyl]isoindole-1,3-dione IUPAC Name: 2-[2-(1-amino-4-phenylimidazol-2-yl)sulfanylethyl]isoindole-1,3-dione Traditional Name: 2-[2-[(1-amino-4-phenyl-imidazol-2-yl)thio]ethyl]isoindoline-1,3-quinone Formula: C19H16N4O2S MolecularWeight: 364.42094

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=CN(C(=N2)SCCN3C(=O)C4=CC=CC=C4C3=O)N

Isomeric SMILES

C1=CC=C(C=C1)C2=CN(C(=N2)SCCN3C(=O)C4=CC=CC=C4C3=O)N

InChI

InChI=1S/C19H16N4O2S/c20-23-12-16(13-6-2-1-3-7-13)21-19(23)26-11-10-22-17(24)14-8-4-5-9-15(14)18(22)25/h1-9,12H,10-11,20H2