1-(1,1-Dimethylethyl) 2-borono-5-[(4-methyl-1-piperazinyl)sulfonyl]-1H-indole-1-carboxylate

CAS Registry Number®

519148-74-4
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CAS Name

1-(1,1-Dimethylethyl) 2-borono-5-[(4-methyl-1-piperazinyl)sulfonyl]-1H-indole-1-carboxylate

Molecular Formula

C18H26BN3O6S

Molecular Mass

423.29

Cite this Page

1-(1,1-Dimethylethyl) 2-borono-5-[(4-methyl-1-piperazinyl)sulfonyl]-1H-indole-1-carboxylate.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=519148-74-4 (retrieved 2024-09-07) (CAS RN: 519148-74-4).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C18H26BN3O6S/c1-18(2,3)28-17(23)22-15-6-5-14(11-13(15)12-16(22)19(24)25)29(26,27)21-9-7-20(4)8-10-21/h5-6,11-12,24-25H,7-10H2,1-4H3

InChIKey

InChIKey=NSTXUORBJMZTCP-UHFFFAOYSA-N

SMILES

C(OC(C)(C)C)(=O)N1C=2C(C=C1B(O)O)=CC(S(=O)(=O)N3CCN(C)CC3)=CC2

Canonical SMILES

O=C(OC(C)(C)C)N1C(=CC=2C=C(C=CC21)S(=O)(=O)N3CCN(C)CC3)B(O)O

Other Names for this Substance

  • 1H-Indole-1-carboxylic acid, 2-borono-5-[(4-methyl-1-piperazinyl)sulfonyl]-, 1-(1,1-dimethylethyl) ester
  • 1-(1,1-Dimethylethyl) 2-borono-5-[(4-methyl-1-piperazinyl)sulfonyl]-1H-indole-1-carboxylate
  • [1-(tert-Butoxycarbonyl)-5-[(4-methylpiperazin-1-yl)sulfonyl]indol-2-yl]boronic acid