N-(2-piperidin-1-ylcarbonyl-5-propyl-phenyl)-2,1,3-benzothiadiazole-4-sulfonamide

Systemtic Name: N-(2-piperidin-1-ylcarbonyl-5-propyl-phenyl)-2,1,3-benzothiadiazole-4-sulfonamide Openeye Name: N-[2-(piperidine-1-carbonyl)-5-propyl-phenyl]-2,1,3-benzothiadiazole-4-sulfonamide CAS Name: N-[2-[oxo(1-piperidinyl)methyl]-5-propylphenyl]-2,1,3-benzothiadiazole-4-sulfonamide IUPAC Name: N-[2-(piperidine-1-carbonyl)-5-propylphenyl]-2,1,3-benzothiadiazole-4-sulfonamide Traditional Name: N-[2-(piperidine-1-carbonyl)-5-propyl-phenyl]piazthiole-4-sulfonamide Formula: C21H24N4O3S2 MolecularWeight: 444.57026

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=CC(=C(C=C1)C(=O)N2CCCCC2)NS(=O)(=O)C3=CC=CC4=NSN=C43

Isomeric SMILES

CCCC1=CC(=C(C=C1)C(=O)N2CCCCC2)NS(=O)(=O)C3=CC=CC4=NSN=C43

InChI

InChI=1S/C21H24N4O3S2/c1-2-7-15-10-11-16(21(26)25-12-4-3-5-13-25)18(14-15)24-30(27,28)19-9-6-8-17-20(19)23-29-22-17/h6,8-11,14,24H,2-5,7,12-13H2,1H3