N-(6-methylsulfonyl-1,3-benzothiazol-2-yl)-3-(4-oxidanylidenequinazolin-3-yl)propanamide

Systemtic Name: N-(6-methylsulfonyl-1,3-benzothiazol-2-yl)-3-(4-oxidanylidenequinazolin-3-yl)propanamide Openeye Name: N-(6-methylsulfonyl-1,3-benzothiazol-2-yl)-3-(4-oxoquinazolin-3-yl)propanamide CAS Name: N-(6-methylsulfonyl-1,3-benzothiazol-2-yl)-3-(4-oxo-3-quinazolinyl)propanamide IUPAC Name: N-(6-methylsulfonyl-1,3-benzothiazol-2-yl)-3-(4-oxoquinazolin-3-yl)propanamide Traditional Name: 3-(4-ketoquinazolin-3-yl)-N-(6-mesyl-1,3-benzothiazol-2-yl)propionamide Formula: C19H16N4O4S2 MolecularWeight: 428.48474

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC2=C(C=C1)N=C(S2)NC(=O)CCN3C=NC4=CC=CC=C4C3=O

Isomeric SMILES

CS(=O)(=O)C1=CC2=C(C=C1)N=C(S2)NC(=O)CCN3C=NC4=CC=CC=C4C3=O

InChI

InChI=1S/C19H16N4O4S2/c1-29(26,27)12-6-7-15-16(10-12)28-19(21-15)22-17(24)8-9-23-11-20-14-5-3-2-4-13(14)18(23)25/h2-7,10-11H,8-9H2,1H3,(H,21,22,24)