N-tert-butyl-2-[6-[(3S)-3-methylpiperidin-1-yl]sulfonylbenzotriazol-1-yl]oxy-N-(phenylmethyl)ethanamide

Systemtic Name: N-tert-butyl-2-[6-[(3S)-3-methylpiperidin-1-yl]sulfonylbenzotriazol-1-yl]oxy-N-(phenylmethyl)ethanamide Openeye Name: N-benzyl-N-tert-butyl-2-[6-[[(3S)-3-methyl-1-piperidyl]sulfonyl]benzotriazol-1-yl]oxy-acetamide CAS Name: N-tert-butyl-2-[[6-[[(3S)-3-methyl-1-piperidinyl]sulfonyl]-1-benzotriazolyl]oxy]-N-(phenylmethyl)acetamide IUPAC Name: N-benzyl-N-tert-butyl-2-[6-[(3S)-3-methylpiperidin-1-yl]sulfonylbenzotriazol-1-yl]oxyacetamide Traditional Name: N-benzyl-N-tert-butyl-2-[6-[(3S)-3-methylpiperidino]sulfonylbenzotriazol-1-yl]oxy-acetamide Formula: C25H33N5O4S MolecularWeight: 499.62562

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCN(C1)S(=O)(=O)C2=CC3=C(C=C2)N=NN3OCC(=O)N(CC4=CC=CC=C4)C(C)(C)C

Isomeric SMILES

C[C@H]1CCCN(C1)S(=O)(=O)C2=CC3=C(C=C2)N=NN3OCC(=O)N(CC4=CC=CC=C4)C(C)(C)C

InChI

InChI=1S/C25H33N5O4S/c1-19-9-8-14-28(16-19)35(32,33)21-12-13-22-23(15-21)30(27-26-22)34-18-24(31)29(25(2,3)4)17-20-10-6-5-7-11-20/h5-7,10-13,15,19H,8-9,14,16-18H2,1-4H3/t19-/m0/s1