N-[2-(1,3-benzothiazol-2-yl)phenyl]-4-(4-oxidanylidenequinazolin-3-yl)butanamide

Systemtic Name: N-[2-(1,3-benzothiazol-2-yl)phenyl]-4-(4-oxidanylidenequinazolin-3-yl)butanamide Openeye Name: N-[2-(1,3-benzothiazol-2-yl)phenyl]-4-(4-oxoquinazolin-3-yl)butanamide CAS Name: N-[2-(1,3-benzothiazol-2-yl)phenyl]-4-(4-oxo-3-quinazolinyl)butanamide IUPAC Name: N-[2-(1,3-benzothiazol-2-yl)phenyl]-4-(4-oxoquinazolin-3-yl)butanamide Traditional Name: N-[2-(1,3-benzothiazol-2-yl)phenyl]-4-(4-ketoquinazolin-3-yl)butyramide Formula: C25H20N4O2S MolecularWeight: 440.5169

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)N(C=N2)CCCC(=O)NC3=CC=CC=C3C4=NC5=CC=CC=C5S4

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)N(C=N2)CCCC(=O)NC3=CC=CC=C3C4=NC5=CC=CC=C5S4

InChI

InChI=1S/C25H20N4O2S/c30-23(14-7-15-29-16-26-19-10-3-2-9-18(19)25(29)31)27-20-11-4-1-8-17(20)24-28-21-12-5-6-13-22(21)32-24/h1-6,8-13,16H,7,14-15H2,(H,27,30)