N-(2-fluorophenyl)-2-[6-(3-methylpiperidin-1-yl)sulfonylbenzotriazol-1-yl]oxy-propanamide

Systemtic Name: N-(2-fluorophenyl)-2-[6-(3-methylpiperidin-1-yl)sulfonylbenzotriazol-1-yl]oxy-propanamide Openeye Name: N-(2-fluorophenyl)-2-[6-[(3-methyl-1-piperidyl)sulfonyl]benzotriazol-1-yl]oxy-propanamide CAS Name: N-(2-fluorophenyl)-2-[[6-[(3-methyl-1-piperidinyl)sulfonyl]-1-benzotriazolyl]oxy]propanamide IUPAC Name: N-(2-fluorophenyl)-2-[6-(3-methylpiperidin-1-yl)sulfonylbenzotriazol-1-yl]oxypropanamide Traditional Name: N-(2-fluorophenyl)-2-[6-(3-methylpiperidino)sulfonylbenzotriazol-1-yl]oxy-propionamide Formula: C21H24FN5O4S MolecularWeight: 461.509763

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCN(C1)S(=O)(=O)C2=CC3=C(C=C2)N=NN3OC(C)C(=O)NC4=CC=CC=C4F

Isomeric SMILES

CC1CCCN(C1)S(=O)(=O)C2=CC3=C(C=C2)N=NN3OC(C)C(=O)NC4=CC=CC=C4F

InChI

InChI=1S/C21H24FN5O4S/c1-14-6-5-11-26(13-14)32(29,30)16-9-10-19-20(12-16)27(25-24-19)31-15(2)21(28)23-18-8-4-3-7-17(18)22/h3-4,7-10,12,14-15H,5-6,11,13H2,1-2H3,(H,23,28)