4-[(2S)-2-(1,3-benzothiazol-2-yl)piperidin-1-yl]sulfonyl-2,1,3-benzothiadiazole

Systemtic Name: 4-[(2S)-2-(1,3-benzothiazol-2-yl)piperidin-1-yl]sulfonyl-2,1,3-benzothiadiazole Openeye Name: 4-[[(2S)-2-(1,3-benzothiazol-2-yl)-1-piperidyl]sulfonyl]-2,1,3-benzothiadiazole CAS Name: 4-[[(2S)-2-(1,3-benzothiazol-2-yl)-1-piperidinyl]sulfonyl]-2,1,3-benzothiadiazole IUPAC Name: 4-[(2S)-2-(1,3-benzothiazol-2-yl)piperidin-1-yl]sulfonyl-2,1,3-benzothiadiazole Traditional Name: 4-[(2S)-2-(1,3-benzothiazol-2-yl)piperidino]sulfonylpiazthiole Formula: C18H16N4O2S3 MolecularWeight: 416.54024

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C(C1)C2=NC3=CC=CC=C3S2)S(=O)(=O)C4=CC=CC5=NSN=C54

Isomeric SMILES

C1CCN([C@@H](C1)C2=NC3=CC=CC=C3S2)S(=O)(=O)C4=CC=CC5=NSN=C54

InChI

InChI=1S/C18H16N4O2S3/c23-27(24,16-10-5-7-13-17(16)21-26-20-13)22-11-4-3-8-14(22)18-19-12-6-1-2-9-15(12)25-18/h1-2,5-7,9-10,14H,3-4,8,11H2/t14-/m0/s1