4-[4-(3-chlorophenyl)piperazin-1-yl]-N-(6-methylsulfonyl-1,3-benzothiazol-2-yl)-4-oxidanylidene-butanamide

Systemtic Name: 4-[4-(3-chlorophenyl)piperazin-1-yl]-N-(6-methylsulfonyl-1,3-benzothiazol-2-yl)-4-oxidanylidene-butanamide Openeye Name: 4-[4-(3-chlorophenyl)piperazin-1-yl]-N-(6-methylsulfonyl-1,3-benzothiazol-2-yl)-4-oxo-butanamide CAS Name: 4-[4-(3-chlorophenyl)-1-piperazinyl]-N-(6-methylsulfonyl-1,3-benzothiazol-2-yl)-4-oxobutanamide IUPAC Name: 4-[4-(3-chlorophenyl)piperazin-1-yl]-N-(6-methylsulfonyl-1,3-benzothiazol-2-yl)-4-oxobutanamide Traditional Name: 4-[4-(3-chlorophenyl)piperazino]-4-keto-N-(6-mesyl-1,3-benzothiazol-2-yl)butyramide Formula: C22H23ClN4O4S2 MolecularWeight: 507.02542

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)CCC(=O)N3CCN(CC3)C4=CC(=CC=C4)Cl

Isomeric SMILES

CS(=O)(=O)C1=CC2=C(C=C1)N=C(S2)NC(=O)CCC(=O)N3CCN(CC3)C4=CC(=CC=C4)Cl

InChI

InChI=1S/C22H23ClN4O4S2/c1-33(30,31)17-5-6-18-19(14-17)32-22(24-18)25-20(28)7-8-21(29)27-11-9-26(10-12-27)16-4-2-3-15(23)13-16/h2-6,13-14H,7-12H2,1H3,(H,24,25,28)