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

Systemtic Name: N-(5-ethylsulfanyl-2-piperidin-1-ylcarbonyl-phenyl)-2,1,3-benzothiadiazole-4-sulfonamide Openeye Name: N-[5-ethylsulfanyl-2-(piperidine-1-carbonyl)phenyl]-2,1,3-benzothiadiazole-4-sulfonamide CAS Name: N-[5-(ethylthio)-2-[oxo(1-piperidinyl)methyl]phenyl]-2,1,3-benzothiadiazole-4-sulfonamide IUPAC Name: N-[5-ethylsulfanyl-2-(piperidine-1-carbonyl)phenyl]-2,1,3-benzothiadiazole-4-sulfonamide Traditional Name: N-[5-(ethylthio)-2-(piperidine-1-carbonyl)phenyl]piazthiole-4-sulfonamide Formula: C20H22N4O3S3 MolecularWeight: 462.60868

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Descriptors Computed from Structure

Canonical SMILES:

CCSC1=CC(=C(C=C1)C(=O)N2CCCCC2)NS(=O)(=O)C3=CC=CC4=NSN=C43

Isomeric SMILES

CCSC1=CC(=C(C=C1)C(=O)N2CCCCC2)NS(=O)(=O)C3=CC=CC4=NSN=C43

InChI

InChI=1S/C20H22N4O3S3/c1-2-28-14-9-10-15(20(25)24-11-4-3-5-12-24)17(13-14)23-30(26,27)18-8-6-7-16-19(18)22-29-21-16/h6-10,13,23H,2-5,11-12H2,1H3