N-cyclopropyl-4-[4-(5-fluoranylbenzotriazol-1-yl)piperidin-1-yl]sulfonyl-benzenesulfonamide

Systemtic Name: N-cyclopropyl-4-[4-(5-fluoranylbenzotriazol-1-yl)piperidin-1-yl]sulfonyl-benzenesulfonamide Openeye Name: N-cyclopropyl-4-[[4-(5-fluorobenzotriazol-1-yl)-1-piperidyl]sulfonyl]benzenesulfonamide CAS Name: N-cyclopropyl-4-[[4-(5-fluoro-1-benzotriazolyl)-1-piperidinyl]sulfonyl]benzenesulfonamide IUPAC Name: N-cyclopropyl-4-[4-(5-fluorobenzotriazol-1-yl)piperidin-1-yl]sulfonylbenzenesulfonamide Traditional Name: N-cyclopropyl-4-[4-(5-fluorobenzotriazol-1-yl)piperidino]sulfonyl-benzenesulfonamide Formula: C20H22FN5O4S2 MolecularWeight: 479.548183

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1NS(=O)(=O)C2=CC=C(C=C2)S(=O)(=O)N3CCC(CC3)N4C5=C(C=C(C=C5)F)N=N4

Isomeric SMILES

C1CC1NS(=O)(=O)C2=CC=C(C=C2)S(=O)(=O)N3CCC(CC3)N4C5=C(C=C(C=C5)F)N=N4

InChI

InChI=1S/C20H22FN5O4S2/c21-14-1-8-20-19(13-14)22-24-26(20)16-9-11-25(12-10-16)32(29,30)18-6-4-17(5-7-18)31(27,28)23-15-2-3-15/h1,4-8,13,15-16,23H,2-3,9-12H2