N-[(2S)-1-oxidanylidene-1-(4-pyridin-2-ylpiperazin-1-yl)propan-2-yl]-2,1,3-benzothiadiazole-4-sulfonamide

Systemtic Name: N-[(2S)-1-oxidanylidene-1-(4-pyridin-2-ylpiperazin-1-yl)propan-2-yl]-2,1,3-benzothiadiazole-4-sulfonamide Openeye Name: N-[(1S)-1-methyl-2-oxo-2-[4-(2-pyridyl)piperazin-1-yl]ethyl]-2,1,3-benzothiadiazole-4-sulfonamide CAS Name: N-[(2S)-1-oxo-1-[4-(2-pyridinyl)-1-piperazinyl]propan-2-yl]-2,1,3-benzothiadiazole-4-sulfonamide IUPAC Name: N-[(2S)-1-oxo-1-(4-pyridin-2-ylpiperazin-1-yl)propan-2-yl]-2,1,3-benzothiadiazole-4-sulfonamide Traditional Name: N-[(1S)-2-keto-1-methyl-2-[4-(2-pyridyl)piperazino]ethyl]piazthiole-4-sulfonamide Formula: C18H20N6O3S2 MolecularWeight: 432.5198

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)N1CCN(CC1)C2=CC=CC=N2)NS(=O)(=O)C3=CC=CC4=NSN=C43

Isomeric SMILES

C[C@@H](C(=O)N1CCN(CC1)C2=CC=CC=N2)NS(=O)(=O)C3=CC=CC4=NSN=C43

InChI

InChI=1S/C18H20N6O3S2/c1-13(22-29(26,27)15-6-4-5-14-17(15)21-28-20-14)18(25)24-11-9-23(10-12-24)16-7-2-3-8-19-16/h2-8,13,22H,9-12H2,1H3/t13-/m0/s1