4-[4-(2,5-dimethylphenyl)sulfonylpiperazin-1-yl]sulfonyl-2,1,3-benzoxadiazole

Systemtic Name: 4-[4-(2,5-dimethylphenyl)sulfonylpiperazin-1-yl]sulfonyl-2,1,3-benzoxadiazole Openeye Name: 4-[4-(2,5-dimethylphenyl)sulfonylpiperazin-1-yl]sulfonyl-2,1,3-benzoxadiazole CAS Name: 4-[[4-(2,5-dimethylphenyl)sulfonyl-1-piperazinyl]sulfonyl]-2,1,3-benzoxadiazole IUPAC Name: 4-[4-(2,5-dimethylphenyl)sulfonylpiperazin-1-yl]sulfonyl-2,1,3-benzoxadiazole Traditional Name: 4-[4-(2,5-dimethylphenyl)sulfonylpiperazino]sulfonylbenzofurazan Formula: C18H20N4O5S2 MolecularWeight: 436.5052

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)S(=O)(=O)N2CCN(CC2)S(=O)(=O)C3=CC=CC4=NON=C43

Isomeric SMILES

CC1=CC(=C(C=C1)C)S(=O)(=O)N2CCN(CC2)S(=O)(=O)C3=CC=CC4=NON=C43

InChI

InChI=1S/C18H20N4O5S2/c1-13-6-7-14(2)17(12-13)29(25,26)22-10-8-21(9-11-22)28(23,24)16-5-3-4-15-18(16)20-27-19-15/h3-7,12H,8-11H2,1-2H3