3-[[3-(1,3-benzothiazol-2-yl)propanoylamino]carbamoyl]-N-(2-chlorophenyl)benzenesulfonamide

Systemtic Name: 3-[[3-(1,3-benzothiazol-2-yl)propanoylamino]carbamoyl]-N-(2-chlorophenyl)benzenesulfonamide Openeye Name: 3-[[3-(1,3-benzothiazol-2-yl)propanoylamino]carbamoyl]-N-(2-chlorophenyl)benzenesulfonamide CAS Name: 3-[[[3-(1,3-benzothiazol-2-yl)-1-oxopropyl]hydrazo]-oxomethyl]-N-(2-chlorophenyl)benzenesulfonamide IUPAC Name: 3-[[3-(1,3-benzothiazol-2-yl)propanoylamino]carbamoyl]-N-(2-chlorophenyl)benzenesulfonamide Traditional Name: 3-[[3-(1,3-benzothiazol-2-yl)propanoylamino]carbamoyl]-N-(2-chlorophenyl)benzenesulfonamide Formula: C23H19ClN4O4S2 MolecularWeight: 515.00436

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)N=C(S2)CCC(=O)NNC(=O)C3=CC(=CC=C3)S(=O)(=O)NC4=CC=CC=C4Cl

Isomeric SMILES

C1=CC=C2C(=C1)N=C(S2)CCC(=O)NNC(=O)C3=CC(=CC=C3)S(=O)(=O)NC4=CC=CC=C4Cl

InChI

InChI=1S/C23H19ClN4O4S2/c24-17-8-1-2-9-18(17)28-34(31,32)16-7-5-6-15(14-16)23(30)27-26-21(29)12-13-22-25-19-10-3-4-11-20(19)33-22/h1-11,14,28H,12-13H2,(H,26,29)(H,27,30)