4-[(3S)-4-(2,1,3-benzothiadiazol-4-ylsulfonyl)-3-methyl-piperazin-1-yl]sulfonyl-2,1,3-benzothiadiazole

Systemtic Name: 4-[(3S)-4-(2,1,3-benzothiadiazol-4-ylsulfonyl)-3-methyl-piperazin-1-yl]sulfonyl-2,1,3-benzothiadiazole Openeye Name: 4-[(3S)-4-(2,1,3-benzothiadiazol-4-ylsulfonyl)-3-methyl-piperazin-1-yl]sulfonyl-2,1,3-benzothiadiazole CAS Name: 4-[[(3S)-4-(2,1,3-benzothiadiazol-4-ylsulfonyl)-3-methyl-1-piperazinyl]sulfonyl]-2,1,3-benzothiadiazole IUPAC Name: 4-[(3S)-4-(2,1,3-benzothiadiazol-4-ylsulfonyl)-3-methylpiperazin-1-yl]sulfonyl-2,1,3-benzothiadiazole Traditional Name: 4-[(3S)-3-methyl-4-piazthiol-4-ylsulfonyl-piperazino]sulfonylpiazthiole Formula: C17H16N6O4S4 MolecularWeight: 496.60674

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Descriptors Computed from Structure

Canonical SMILES:

CC1CN(CCN1S(=O)(=O)C2=CC=CC3=NSN=C32)S(=O)(=O)C4=CC=CC5=NSN=C54

Isomeric SMILES

C[C@H]1CN(CCN1S(=O)(=O)C2=CC=CC3=NSN=C32)S(=O)(=O)C4=CC=CC5=NSN=C54

InChI

InChI=1S/C17H16N6O4S4/c1-11-10-22(30(24,25)14-6-2-4-12-16(14)20-28-18-12)8-9-23(11)31(26,27)15-7-3-5-13-17(15)21-29-19-13/h2-7,11H,8-10H2,1H3/t11-/m0/s1