N-[3-chloranyl-4-(4-thiophen-2-ylcarbonylpiperazin-1-yl)phenyl]-2,1,3-benzothiadiazole-5-carboxamide

Systemtic Name: N-[3-chloranyl-4-(4-thiophen-2-ylcarbonylpiperazin-1-yl)phenyl]-2,1,3-benzothiadiazole-5-carboxamide Openeye Name: N-[3-chloro-4-[4-(thiophene-2-carbonyl)piperazin-1-yl]phenyl]-2,1,3-benzothiadiazole-5-carboxamide CAS Name: N-[3-chloro-4-[4-[oxo(thiophen-2-yl)methyl]-1-piperazinyl]phenyl]-2,1,3-benzothiadiazole-5-carboxamide IUPAC Name: N-[3-chloro-4-[4-(thiophene-2-carbonyl)piperazin-1-yl]phenyl]-2,1,3-benzothiadiazole-5-carboxamide Traditional Name: N-[3-chloro-4-[4-(2-thenoyl)piperazino]phenyl]piazthiole-5-carboxamide Formula: C22H18ClN5O2S2 MolecularWeight: 483.99362

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=C(C=C(C=C2)NC(=O)C3=CC4=NSN=C4C=C3)Cl)C(=O)C5=CC=CS5

Isomeric SMILES

C1CN(CCN1C2=C(C=C(C=C2)NC(=O)C3=CC4=NSN=C4C=C3)Cl)C(=O)C5=CC=CS5

InChI

InChI=1S/C22H18ClN5O2S2/c23-16-13-15(24-21(29)14-3-5-17-18(12-14)26-32-25-17)4-6-19(16)27-7-9-28(10-8-27)22(30)20-2-1-11-31-20/h1-6,11-13H,7-10H2,(H,24,29)