1-[4-[4-(5-fluoranylbenzotriazol-1-yl)piperidin-1-yl]sulfonylphenyl]ethanone

Systemtic Name: 1-[4-[4-(5-fluoranylbenzotriazol-1-yl)piperidin-1-yl]sulfonylphenyl]ethanone Openeye Name: 1-[4-[[4-(5-fluorobenzotriazol-1-yl)-1-piperidyl]sulfonyl]phenyl]ethanone CAS Name: 1-[4-[[4-(5-fluoro-1-benzotriazolyl)-1-piperidinyl]sulfonyl]phenyl]ethanone IUPAC Name: 1-[4-[4-(5-fluorobenzotriazol-1-yl)piperidin-1-yl]sulfonylphenyl]ethanone Traditional Name: 1-[4-[4-(5-fluorobenzotriazol-1-yl)piperidino]sulfonylphenyl]ethanone Formula: C19H19FN4O3S MolecularWeight: 402.442563

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC=C(C=C1)S(=O)(=O)N2CCC(CC2)N3C4=C(C=C(C=C4)F)N=N3

Isomeric SMILES

CC(=O)C1=CC=C(C=C1)S(=O)(=O)N2CCC(CC2)N3C4=C(C=C(C=C4)F)N=N3

InChI

InChI=1S/C19H19FN4O3S/c1-13(25)14-2-5-17(6-3-14)28(26,27)23-10-8-16(9-11-23)24-19-7-4-15(20)12-18(19)21-22-24/h2-7,12,16H,8-11H2,1H3