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

Systemtic Name: N-[2-(4-methylsulfonylpiperazin-1-yl)phenyl]-2,1,3-benzothiadiazole-5-carboxamide Openeye Name: N-[2-(4-methylsulfonylpiperazin-1-yl)phenyl]-2,1,3-benzothiadiazole-5-carboxamide CAS Name: N-[2-(4-methylsulfonyl-1-piperazinyl)phenyl]-2,1,3-benzothiadiazole-5-carboxamide IUPAC Name: N-[2-(4-methylsulfonylpiperazin-1-yl)phenyl]-2,1,3-benzothiadiazole-5-carboxamide Traditional Name: N-[2-(4-mesylpiperazino)phenyl]piazthiole-5-carboxamide Formula: C18H19N5O3S2 MolecularWeight: 417.50516

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)N1CCN(CC1)C2=CC=CC=C2NC(=O)C3=CC4=NSN=C4C=C3

Isomeric SMILES

CS(=O)(=O)N1CCN(CC1)C2=CC=CC=C2NC(=O)C3=CC4=NSN=C4C=C3

InChI

InChI=1S/C18H19N5O3S2/c1-28(25,26)23-10-8-22(9-11-23)17-5-3-2-4-15(17)19-18(24)13-6-7-14-16(12-13)21-27-20-14/h2-7,12H,8-11H2,1H3,(H,19,24)