N-[4-[4-(phenylcarbonyl)piperazin-1-yl]phenyl]-2,1,3-benzothiadiazole-5-carboxamide

Systemtic Name: N-[4-[4-(phenylcarbonyl)piperazin-1-yl]phenyl]-2,1,3-benzothiadiazole-5-carboxamide Openeye Name: N-[4-(4-benzoylpiperazin-1-yl)phenyl]-2,1,3-benzothiadiazole-5-carboxamide CAS Name: N-[4-(4-benzoyl-1-piperazinyl)phenyl]-2,1,3-benzothiadiazole-5-carboxamide IUPAC Name: N-[4-(4-benzoylpiperazin-1-yl)phenyl]-2,1,3-benzothiadiazole-5-carboxamide Traditional Name: N-[4-(4-benzoylpiperazino)phenyl]piazthiole-5-carboxamide Formula: C24H21N5O2S MolecularWeight: 443.52084

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC=C(C=C2)NC(=O)C3=CC4=NSN=C4C=C3)C(=O)C5=CC=CC=C5

Isomeric SMILES

C1CN(CCN1C2=CC=C(C=C2)NC(=O)C3=CC4=NSN=C4C=C3)C(=O)C5=CC=CC=C5

InChI

InChI=1S/C24H21N5O2S/c30-23(18-6-11-21-22(16-18)27-32-26-21)25-19-7-9-20(10-8-19)28-12-14-29(15-13-28)24(31)17-4-2-1-3-5-17/h1-11,16H,12-15H2,(H,25,30)