N-[(1,2-Dimethyl-1H-imidazol-4-yl)sulfonyl]-β-alanine

CAS Registry Number®

1240526-74-2
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CAS Name

N-[(1,2-Dimethyl-1H-imidazol-4-yl)sulfonyl]-β-alanine

Molecular Formula

C8H13N3O4S

Molecular Mass

247.27

Cite this Page

N-[(1,2-Dimethyl-1H-imidazol-4-yl)sulfonyl]-β-alanine.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=1240526-74-2 (retrieved 2024-07-08) (CAS RN: 1240526-74-2).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C8H13N3O4S/c1-6-10-7(5-11(6)2)16(14,15)9-4-3-8(12)13/h5,9H,3-4H2,1-2H3,(H,12,13)

InChIKey

InChIKey=OQKWFFHPGWAWHW-UHFFFAOYSA-N

SMILES

S(NCCC(O)=O)(=O)(=O)C1=CN(C)C(C)=N1

Canonical SMILES

O=C(O)CCNS(=O)(=O)C=1N=C(N(C1)C)C

Other Names for this Substance

  • β-Alanine, N-[(1,2-dimethyl-1H-imidazol-4-yl)sulfonyl]-
  • N-[(1,2-Dimethyl-1H-imidazol-4-yl)sulfonyl]-β-alanine