2-[2-[(4-oxidanylidene-1H-quinazolin-2-yl)sulfanyl]ethyl]isoindole-1,3-dione

Systemtic Name: 2-[2-[(4-oxidanylidene-1H-quinazolin-2-yl)sulfanyl]ethyl]isoindole-1,3-dione Openeye Name: 2-[2-[(4-oxo-1H-quinazolin-2-yl)sulfanyl]ethyl]isoindoline-1,3-dione CAS Name: 2-[2-[(4-oxo-1H-quinazolin-2-yl)thio]ethyl]isoindole-1,3-dione IUPAC Name: 2-[2-[(4-oxo-1H-quinazolin-2-yl)sulfanyl]ethyl]isoindole-1,3-dione Traditional Name: 2-[2-[(4-keto-1H-quinazolin-2-yl)thio]ethyl]isoindoline-1,3-quinone Formula: C18H13N3O3S MolecularWeight: 351.37912

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)N(C2=O)CCSC3=NC(=O)C4=CC=CC=C4N3

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)N(C2=O)CCSC3=NC(=O)C4=CC=CC=C4N3

InChI

InChI=1S/C18H13N3O3S/c22-15-13-7-3-4-8-14(13)19-18(20-15)25-10-9-21-16(23)11-5-1-2-6-12(11)17(21)24/h1-8H,9-10H2,(H,19,20,22)