N-[1-(4-fluorophenyl)ethyl]-2-[6-(3-methylpiperidin-1-yl)sulfonylbenzotriazol-1-yl]oxy-ethanamide

Systemtic Name: N-[1-(4-fluorophenyl)ethyl]-2-[6-(3-methylpiperidin-1-yl)sulfonylbenzotriazol-1-yl]oxy-ethanamide Openeye Name: N-[1-(4-fluorophenyl)ethyl]-2-[6-[(3-methyl-1-piperidyl)sulfonyl]benzotriazol-1-yl]oxy-acetamide CAS Name: N-[1-(4-fluorophenyl)ethyl]-2-[[6-[(3-methyl-1-piperidinyl)sulfonyl]-1-benzotriazolyl]oxy]acetamide IUPAC Name: N-[1-(4-fluorophenyl)ethyl]-2-[6-(3-methylpiperidin-1-yl)sulfonylbenzotriazol-1-yl]oxyacetamide Traditional Name: N-[1-(4-fluorophenyl)ethyl]-2-[6-(3-methylpiperidino)sulfonylbenzotriazol-1-yl]oxy-acetamide Formula: C22H26FN5O4S MolecularWeight: 475.536343

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCN(C1)S(=O)(=O)C2=CC3=C(C=C2)N=NN3OCC(=O)NC(C)C4=CC=C(C=C4)F

Isomeric SMILES

CC1CCCN(C1)S(=O)(=O)C2=CC3=C(C=C2)N=NN3OCC(=O)NC(C)C4=CC=C(C=C4)F

InChI

InChI=1S/C22H26FN5O4S/c1-15-4-3-11-27(13-15)33(30,31)19-9-10-20-21(12-19)28(26-25-20)32-14-22(29)24-16(2)17-5-7-18(23)8-6-17/h5-10,12,15-16H,3-4,11,13-14H2,1-2H3,(H,24,29)