4-[4-oxidanylidene-2-[(2-phenyl-1,3-thiazol-4-yl)methylsulfanyl]quinazolin-3-yl]benzenecarbonitrile

Systemtic Name: 4-[4-oxidanylidene-2-[(2-phenyl-1,3-thiazol-4-yl)methylsulfanyl]quinazolin-3-yl]benzenecarbonitrile Openeye Name: 4-[4-oxo-2-[(2-phenylthiazol-4-yl)methylsulfanyl]quinazolin-3-yl]benzonitrile CAS Name: 4-[4-oxo-2-[(2-phenyl-4-thiazolyl)methylthio]-3-quinazolinyl]benzonitrile IUPAC Name: 4-[4-oxo-2-[(2-phenyl-1,3-thiazol-4-yl)methylsulfanyl]quinazolin-3-yl]benzonitrile Traditional Name: 4-[4-keto-2-[(2-phenylthiazol-4-yl)methylthio]quinazolin-3-yl]benzonitrile Formula: C25H16N4OS2 MolecularWeight: 452.55074

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=NC(=CS2)CSC3=NC4=CC=CC=C4C(=O)N3C5=CC=C(C=C5)C#N

Isomeric SMILES

C1=CC=C(C=C1)C2=NC(=CS2)CSC3=NC4=CC=CC=C4C(=O)N3C5=CC=C(C=C5)C#N

InChI

InChI=1S/C25H16N4OS2/c26-14-17-10-12-20(13-11-17)29-24(30)21-8-4-5-9-22(21)28-25(29)32-16-19-15-31-23(27-19)18-6-2-1-3-7-18/h1-13,15H,16H2