N-[3-[4-(3-methylphenyl)piperazin-1-yl]propyl]-2,1,3-benzothiadiazole-4-sulfonamide

Systemtic Name: N-[3-[4-(3-methylphenyl)piperazin-1-yl]propyl]-2,1,3-benzothiadiazole-4-sulfonamide Openeye Name: N-[3-[4-(m-tolyl)piperazin-1-yl]propyl]-2,1,3-benzothiadiazole-4-sulfonamide CAS Name: N-[3-[4-(3-methylphenyl)-1-piperazinyl]propyl]-2,1,3-benzothiadiazole-4-sulfonamide IUPAC Name: N-[3-[4-(3-methylphenyl)piperazin-1-yl]propyl]-2,1,3-benzothiadiazole-4-sulfonamide Traditional Name: N-[3-[4-(m-tolyl)piperazino]propyl]piazthiole-4-sulfonamide Formula: C20H25N5O2S2 MolecularWeight: 431.5748

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)N2CCN(CC2)CCCNS(=O)(=O)C3=CC=CC4=NSN=C43

Isomeric SMILES

CC1=CC(=CC=C1)N2CCN(CC2)CCCNS(=O)(=O)C3=CC=CC4=NSN=C43

InChI

InChI=1S/C20H25N5O2S2/c1-16-5-2-6-17(15-16)25-13-11-24(12-14-25)10-4-9-21-29(26,27)19-8-3-7-18-20(19)23-28-22-18/h2-3,5-8,15,21H,4,9-14H2,1H3