1,1-Dimethylethyl N-[(1S)-3-methyl-1-[(6-nitro-1H-benzotriazol-1-yl)thioxomethyl]butyl]carbamate

CAS Registry Number®

214750-70-6

CAS Name

1,1-Dimethylethyl N-[(1S)-3-methyl-1-[(6-nitro-1H-benzotriazol-1-yl)thioxomethyl]butyl]carbamate

Molecular Formula

C17H23N5O4S

Molecular Mass

393.46

Cite this Page

1,1-Dimethylethyl N-[(1S)-3-methyl-1-[(6-nitro-1H-benzotriazol-1-yl)thioxomethyl]butyl]carbamate.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=214750-70-6 (retrieved 2024-11-21) (CAS RN: 214750-70-6).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C17H23N5O4S/c1-10(2)8-13(18-16(23)26-17(3,4)5)15(27)21-14-9-11(22(24)25)6-7-12(14)19-20-21/h6-7,9-10,13H,8H2,1-5H3,(H,18,23)/t13-/m0/s1

InChIKey

InChIKey=PMAXTLKKSQZVKQ-ZDUSSCGKSA-N

SMILES

C([C@@H](NC(OC(C)(C)C)=O)CC(C)C)(=S)N1C=2C(N=N1)=CC=C(N(=O)=O)C2

Canonical SMILES

O=C(OC(C)(C)C)NC(C(=S)N1N=NC=2C=CC(=CC21)N(=O)=O)CC(C)C

Other Names for this Substance

  • Carbamic acid, N-[(1S)-3-methyl-1-[(6-nitro-1H-benzotriazol-1-yl)thioxomethyl]butyl]-, 1,1-dimethylethyl ester
  • Carbamic acid, [(1S)-3-methyl-1-[(6-nitro-1H-benzotriazol-1-yl)thioxomethyl]butyl]-, 1,1-dimethylethyl ester
  • 1,1-Dimethylethyl N-[(1S)-3-methyl-1-[(6-nitro-1H-benzotriazol-1-yl)thioxomethyl]butyl]carbamate

Deleted or Replaced CAS Registry Numbers

1253799-48-2

CAS INSIGHTSTM
Targeted protein degrader structure, illustration