N-[(4-fluorophenyl)methyl]-2-(6-piperidin-1-ylsulfonylbenzotriazol-1-yl)oxy-ethanamide

Systemtic Name: N-[(4-fluorophenyl)methyl]-2-(6-piperidin-1-ylsulfonylbenzotriazol-1-yl)oxy-ethanamide Openeye Name: N-[(4-fluorophenyl)methyl]-2-[6-(1-piperidylsulfonyl)benzotriazol-1-yl]oxy-acetamide CAS Name: N-[(4-fluorophenyl)methyl]-2-[[6-(1-piperidinylsulfonyl)-1-benzotriazolyl]oxy]acetamide IUPAC Name: N-[(4-fluorophenyl)methyl]-2-(6-piperidin-1-ylsulfonylbenzotriazol-1-yl)oxyacetamide Traditional Name: N-(4-fluorobenzyl)-2-(6-piperidinosulfonylbenzotriazol-1-yl)oxy-acetamide Formula: C20H22FN5O4S MolecularWeight: 447.483183

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)S(=O)(=O)C2=CC3=C(C=C2)N=NN3OCC(=O)NCC4=CC=C(C=C4)F

Isomeric SMILES

C1CCN(CC1)S(=O)(=O)C2=CC3=C(C=C2)N=NN3OCC(=O)NCC4=CC=C(C=C4)F

InChI

InChI=1S/C20H22FN5O4S/c21-16-6-4-15(5-7-16)13-22-20(27)14-30-26-19-12-17(8-9-18(19)23-24-26)31(28,29)25-10-2-1-3-11-25/h4-9,12H,1-3,10-11,13-14H2,(H,22,27)