4-[4-[(3-butyl-1,2,4-oxadiazol-5-yl)methyl]piperazin-1-yl]sulfonylbenzenesulfonamide

Systemtic Name: 4-[4-[(3-butyl-1,2,4-oxadiazol-5-yl)methyl]piperazin-1-yl]sulfonylbenzenesulfonamide Openeye Name: 4-[4-[(3-butyl-1,2,4-oxadiazol-5-yl)methyl]piperazin-1-yl]sulfonylbenzenesulfonamide CAS Name: 4-[[4-[(3-butyl-1,2,4-oxadiazol-5-yl)methyl]-1-piperazinyl]sulfonyl]benzenesulfonamide IUPAC Name: 4-[4-[(3-butyl-1,2,4-oxadiazol-5-yl)methyl]piperazin-1-yl]sulfonylbenzenesulfonamide Traditional Name: 4-[4-[(3-butyl-1,2,4-oxadiazol-5-yl)methyl]piperazino]sulfonylbenzenesulfonamide Formula: C17H25N5O5S2 MolecularWeight: 443.5409

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=NOC(=N1)CN2CCN(CC2)S(=O)(=O)C3=CC=C(C=C3)S(=O)(=O)N

Isomeric SMILES

CCCCC1=NOC(=N1)CN2CCN(CC2)S(=O)(=O)C3=CC=C(C=C3)S(=O)(=O)N

InChI

InChI=1S/C17H25N5O5S2/c1-2-3-4-16-19-17(27-20-16)13-21-9-11-22(12-10-21)29(25,26)15-7-5-14(6-8-15)28(18,23)24/h5-8H,2-4,9-13H2,1H3,(H2,18,23,24)