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

Systemtic Name: N-[(2S)-3-methyl-1-oxidanylidene-1-(4-pyridin-2-ylpiperazin-1-yl)butan-2-yl]-2,1,3-benzothiadiazole-4-sulfonamide Openeye Name: N-[(1S)-2-methyl-1-[4-(2-pyridyl)piperazine-1-carbonyl]propyl]-2,1,3-benzothiadiazole-4-sulfonamide CAS Name: N-[(2S)-3-methyl-1-oxo-1-[4-(2-pyridinyl)-1-piperazinyl]butan-2-yl]-2,1,3-benzothiadiazole-4-sulfonamide IUPAC Name: N-[(2S)-3-methyl-1-oxo-1-(4-pyridin-2-ylpiperazin-1-yl)butan-2-yl]-2,1,3-benzothiadiazole-4-sulfonamide Traditional Name: N-[(1S)-2-methyl-1-[4-(2-pyridyl)piperazine-1-carbonyl]propyl]piazthiole-4-sulfonamide Formula: C20H24N6O3S2 MolecularWeight: 460.57296

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H24N6O3S2/c1-14(2)18(24-31(28,29)16-7-5-6-15-19(16)23-30-22-15)20(27)26-12-10-25(11-13-26)17-8-3-4-9-21-17/h3-9,14,18,24H,10-13H2,1-2H3/t18-/m0/s1