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

Systemtic Name: N-[2-(1,3-benzothiazol-2-yl)phenyl]-3-(4-oxidanylidenequinazolin-3-yl)propanamide Openeye Name: N-[2-(1,3-benzothiazol-2-yl)phenyl]-3-(4-oxoquinazolin-3-yl)propanamide CAS Name: N-[2-(1,3-benzothiazol-2-yl)phenyl]-3-(4-oxo-3-quinazolinyl)propanamide IUPAC Name: N-[2-(1,3-benzothiazol-2-yl)phenyl]-3-(4-oxoquinazolin-3-yl)propanamide Traditional Name: N-[2-(1,3-benzothiazol-2-yl)phenyl]-3-(4-ketoquinazolin-3-yl)propionamide Formula: C24H18N4O2S MolecularWeight: 426.49032

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C24H18N4O2S/c29-22(13-14-28-15-25-18-9-3-2-8-17(18)24(28)30)26-19-10-4-1-7-16(19)23-27-20-11-5-6-12-21(20)31-23/h1-12,15H,13-14H2,(H,26,29)