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

Systemtic Name: N-(5-nitro-2-piperidin-1-ylcarbonyl-phenyl)-2,1,3-benzothiadiazole-4-sulfonamide Openeye Name: N-[5-nitro-2-(piperidine-1-carbonyl)phenyl]-2,1,3-benzothiadiazole-4-sulfonamide CAS Name: N-[5-nitro-2-[oxo(1-piperidinyl)methyl]phenyl]-2,1,3-benzothiadiazole-4-sulfonamide IUPAC Name: N-[5-nitro-2-(piperidine-1-carbonyl)phenyl]-2,1,3-benzothiadiazole-4-sulfonamide Traditional Name: N-[5-nitro-2-(piperidine-1-carbonyl)phenyl]piazthiole-4-sulfonamide Formula: C18H17N5O5S2 MolecularWeight: 447.48808

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C(=O)C2=C(C=C(C=C2)[N+](=O)[O-])NS(=O)(=O)C3=CC=CC4=NSN=C43

Isomeric SMILES

C1CCN(CC1)C(=O)C2=C(C=C(C=C2)[N+](=O)[O-])NS(=O)(=O)C3=CC=CC4=NSN=C43

InChI

InChI=1S/C18H17N5O5S2/c24-18(22-9-2-1-3-10-22)13-8-7-12(23(25)26)11-15(13)21-30(27,28)16-6-4-5-14-17(16)20-29-19-14/h4-8,11,21H,1-3,9-10H2