N-(5-chloranyl-2-pyrrolidin-1-yl-phenyl)-2,1,3-benzothiadiazole-4-sulfonamide

Systemtic Name: N-(5-chloranyl-2-pyrrolidin-1-yl-phenyl)-2,1,3-benzothiadiazole-4-sulfonamide Openeye Name: N-(5-chloro-2-pyrrolidin-1-yl-phenyl)-2,1,3-benzothiadiazole-4-sulfonamide CAS Name: N-[5-chloro-2-(1-pyrrolidinyl)phenyl]-2,1,3-benzothiadiazole-4-sulfonamide IUPAC Name: N-(5-chloro-2-pyrrolidin-1-ylphenyl)-2,1,3-benzothiadiazole-4-sulfonamide Traditional Name: N-(5-chloro-2-pyrrolidino-phenyl)piazthiole-4-sulfonamide Formula: C16H15ClN4O2S2 MolecularWeight: 394.8989

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C2=C(C=C(C=C2)Cl)NS(=O)(=O)C3=CC=CC4=NSN=C43

Isomeric SMILES

C1CCN(C1)C2=C(C=C(C=C2)Cl)NS(=O)(=O)C3=CC=CC4=NSN=C43

InChI

InChI=1S/C16H15ClN4O2S2/c17-11-6-7-14(21-8-1-2-9-21)13(10-11)20-25(22,23)15-5-3-4-12-16(15)19-24-18-12/h3-7,10,20H,1-2,8-9H2