4-Thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid, 6-[(aminophenylacetyl)amino]-3,3-dimethyl-7-oxo-, [2S-[2α,5α,6β(S*)]]-, compd. with N,N-diethylethanamine (1:1)

CAS Registry Number®

1175-97-9

CAS Name

4-Thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid, 6-[(aminophenylacetyl)amino]-3,3-dimethyl-7-oxo-, [2S-[2α,5α,6β(S*)]]-, compd. with N,N-diethylethanamine (1:1)

Molecular Formula

C16H19N3O4S.C6H15N

Cite this Page

4-Thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid, 6-[(aminophenylacetyl)amino]-3,3-dimethyl-7-oxo-, [2S-[2α,5α,6β(S*)]]-, compd. with N,N-diethylethanamine (1:1).   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=1175-97-9 (retrieved 2024-11-22) (CAS RN: 1175-97-9).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C16H19N3O4S.C6H15N/c1-16(2)11(15(22)23)19-13(21)10(14(19)24-16)18-12(20)9(17)8-6-4-3-5-7-8;1-4-7(5-2)6-3/h3-7,9-11,14H,17H2,1-2H3,(H,18,20)(H,22,23);4-6H2,1-3H3/t9-,10-,11+,14-;/m1./s1

InChIKey

InChIKey=YSJVIONGMLEATH-YWUHCJSESA-N

SMILES

N(CC)(CC)CC.C(O)(=O)[C@@H]1N2[C@@]([C@H](NC([C@H](N)C3=CC=CC=C3)=O)C2=O)(SC1(C)C)[H]

Canonical SMILES

O=C(O)C1N2C(=O)C(NC(=O)C(N)C=3C=CC=CC3)C2SC1(C)C.N(CC)(CC)CC

Other Names for this Substance

  • 4-Thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid, 6-[(aminophenylacetyl)amino]-3,3-dimethyl-7-oxo-, [2S-[2α,5α,6β(S*)]]-, compd. with N,N-diethylethanamine (1:1)
  • 4-Thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid, 6-(2-amino-2-phenylacetamido)-3,3-dimethyl-7-oxo-, compd. with triethylamine (1:1)
  • Ethanamine, N,N-diethyl-, [2S-[2α,5α,6β(S*)]]-6-[(aminophenylacetyl)amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylate
  • D-α-Aminobenzylpenicillin triethylamine salt
  • α-(Aminobenzyl)penicillin triethylamine salt

View All

Deleted or Replaced CAS Registry Numbers

50532-70-2

CAS INSIGHTSTM
Targeted protein degrader structure, illustration