N-(1,3-benzodioxol-5-ylmethyl)-2-[6-[(3S)-3-methylpiperidin-1-yl]sulfonylbenzotriazol-1-yl]oxy-ethanamide

Systemtic Name: N-(1,3-benzodioxol-5-ylmethyl)-2-[6-[(3S)-3-methylpiperidin-1-yl]sulfonylbenzotriazol-1-yl]oxy-ethanamide Openeye Name: N-(1,3-benzodioxol-5-ylmethyl)-2-[6-[[(3S)-3-methyl-1-piperidyl]sulfonyl]benzotriazol-1-yl]oxy-acetamide CAS Name: N-(1,3-benzodioxol-5-ylmethyl)-2-[[6-[[(3S)-3-methyl-1-piperidinyl]sulfonyl]-1-benzotriazolyl]oxy]acetamide IUPAC Name: N-(1,3-benzodioxol-5-ylmethyl)-2-[6-[(3S)-3-methylpiperidin-1-yl]sulfonylbenzotriazol-1-yl]oxyacetamide Traditional Name: 2-[6-[(3S)-3-methylpiperidino]sulfonylbenzotriazol-1-yl]oxy-N-piperonyl-acetamide Formula: C22H25N5O6S MolecularWeight: 487.5288

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCN(C1)S(=O)(=O)C2=CC3=C(C=C2)N=NN3OCC(=O)NCC4=CC5=C(C=C4)OCO5

Isomeric SMILES

C[C@H]1CCCN(C1)S(=O)(=O)C2=CC3=C(C=C2)N=NN3OCC(=O)NCC4=CC5=C(C=C4)OCO5

InChI

InChI=1S/C22H25N5O6S/c1-15-3-2-8-26(12-15)34(29,30)17-5-6-18-19(10-17)27(25-24-18)33-13-22(28)23-11-16-4-7-20-21(9-16)32-14-31-20/h4-7,9-10,15H,2-3,8,11-14H2,1H3,(H,23,28)/t15-/m0/s1