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

Systemtic Name: 4-[4-(3,4-dimethoxyphenyl)sulfonylpiperazin-1-yl]sulfonyl-2,1,3-benzoxadiazole Openeye Name: 4-[4-(3,4-dimethoxyphenyl)sulfonylpiperazin-1-yl]sulfonyl-2,1,3-benzoxadiazole CAS Name: 4-[[4-(3,4-dimethoxyphenyl)sulfonyl-1-piperazinyl]sulfonyl]-2,1,3-benzoxadiazole IUPAC Name: 4-[4-(3,4-dimethoxyphenyl)sulfonylpiperazin-1-yl]sulfonyl-2,1,3-benzoxadiazole Traditional Name: 4-[4-(3,4-dimethoxyphenyl)sulfonylpiperazino]sulfonylbenzofurazan Formula: C18H20N4O7S2 MolecularWeight: 468.504

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)S(=O)(=O)N2CCN(CC2)S(=O)(=O)C3=CC=CC4=NON=C43)OC

Isomeric SMILES

COC1=C(C=C(C=C1)S(=O)(=O)N2CCN(CC2)S(=O)(=O)C3=CC=CC4=NON=C43)OC

InChI

InChI=1S/C18H20N4O7S2/c1-27-15-7-6-13(12-16(15)28-2)30(23,24)21-8-10-22(11-9-21)31(25,26)17-5-3-4-14-18(17)20-29-19-14/h3-7,12H,8-11H2,1-2H3