N-[3-[[2-(1,3-benzothiazol-2-ylamino)ethanoylamino]carbamoyl]phenyl]benzenesulfonamide

Systemtic Name: N-[3-[[2-(1,3-benzothiazol-2-ylamino)ethanoylamino]carbamoyl]phenyl]benzenesulfonamide Openeye Name: N-[3-[[[2-(1,3-benzothiazol-2-ylamino)acetyl]amino]carbamoyl]phenyl]benzenesulfonamide CAS Name: N-[3-[[[2-(1,3-benzothiazol-2-ylamino)-1-oxoethyl]hydrazo]-oxomethyl]phenyl]benzenesulfonamide IUPAC Name: N-[3-[[[2-(1,3-benzothiazol-2-ylamino)acetyl]amino]carbamoyl]phenyl]benzenesulfonamide Traditional Name: N-[3-[[[2-(1,3-benzothiazol-2-ylamino)acetyl]amino]carbamoyl]phenyl]benzenesulfonamide Formula: C22H19N5O4S2 MolecularWeight: 481.54736

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)S(=O)(=O)NC2=CC=CC(=C2)C(=O)NNC(=O)CNC3=NC4=CC=CC=C4S3

Isomeric SMILES

C1=CC=C(C=C1)S(=O)(=O)NC2=CC=CC(=C2)C(=O)NNC(=O)CNC3=NC4=CC=CC=C4S3

InChI

InChI=1S/C22H19N5O4S2/c28-20(14-23-22-24-18-11-4-5-12-19(18)32-22)25-26-21(29)15-7-6-8-16(13-15)27-33(30,31)17-9-2-1-3-10-17/h1-13,27H,14H2,(H,23,24)(H,25,28)(H,26,29)