N-[(2-methoxyphenyl)methyl]-2-[6-[(3S)-3-methylpiperidin-1-yl]sulfonylbenzotriazol-1-yl]oxy-ethanamide

Systemtic Name: N-[(2-methoxyphenyl)methyl]-2-[6-[(3S)-3-methylpiperidin-1-yl]sulfonylbenzotriazol-1-yl]oxy-ethanamide Openeye Name: N-[(2-methoxyphenyl)methyl]-2-[6-[[(3S)-3-methyl-1-piperidyl]sulfonyl]benzotriazol-1-yl]oxy-acetamide CAS Name: N-[(2-methoxyphenyl)methyl]-2-[[6-[[(3S)-3-methyl-1-piperidinyl]sulfonyl]-1-benzotriazolyl]oxy]acetamide IUPAC Name: N-[(2-methoxyphenyl)methyl]-2-[6-[(3S)-3-methylpiperidin-1-yl]sulfonylbenzotriazol-1-yl]oxyacetamide Traditional Name: 2-[6-[(3S)-3-methylpiperidino]sulfonylbenzotriazol-1-yl]oxy-N-o-anisyl-acetamide Formula: C22H27N5O5S MolecularWeight: 473.54528

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCN(C1)S(=O)(=O)C2=CC3=C(C=C2)N=NN3OCC(=O)NCC4=CC=CC=C4OC

Isomeric SMILES

C[C@H]1CCCN(C1)S(=O)(=O)C2=CC3=C(C=C2)N=NN3OCC(=O)NCC4=CC=CC=C4OC

InChI

InChI=1S/C22H27N5O5S/c1-16-6-5-11-26(14-16)33(29,30)18-9-10-19-20(12-18)27(25-24-19)32-15-22(28)23-13-17-7-3-4-8-21(17)31-2/h3-4,7-10,12,16H,5-6,11,13-15H2,1-2H3,(H,23,28)/t16-/m0/s1