N-(6-methylsulfonyl-1,3-benzothiazol-2-yl)-3-(3-oxidanylidene-4H-quinoxalin-2-yl)propanamide

Systemtic Name: N-(6-methylsulfonyl-1,3-benzothiazol-2-yl)-3-(3-oxidanylidene-4H-quinoxalin-2-yl)propanamide Openeye Name: N-(6-methylsulfonyl-1,3-benzothiazol-2-yl)-3-(3-oxo-4H-quinoxalin-2-yl)propanamide CAS Name: N-(6-methylsulfonyl-1,3-benzothiazol-2-yl)-3-(3-oxo-4H-quinoxalin-2-yl)propanamide IUPAC Name: N-(6-methylsulfonyl-1,3-benzothiazol-2-yl)-3-(3-oxo-4H-quinoxalin-2-yl)propanamide Traditional Name: 3-(3-keto-4H-quinoxalin-2-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)CCC3=NC4=CC=CC=C4NC3=O

Isomeric SMILES

CS(=O)(=O)C1=CC2=C(C=C1)N=C(S2)NC(=O)CCC3=NC4=CC=CC=C4NC3=O

InChI

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