CAS Registry Number®
118175-11-4
CAS Name
α-Amino-β-methyl-β-sulfino-1H-1,2,3-triazole-1-butanoic acid
Molecular Formula
C7H12N4O4S
Molecular Mass
248.26
Other Names and Identifiers
InChI
InChI=1S/C7H12N4O4S/c1-7(16(14)15,5(8)6(12)13)4-11-3-2-9-10-11/h2-3,5H,4,8H2,1H3,(H,12,13)(H,14,15)
InChIKey
InChIKey=HTKDZWPPZOALOH-UHFFFAOYSA-N
SMILES
C(C(C(O)=O)N)(CN1C=CN=N1)(S(=O)O)C
Canonical SMILES
O=C(O)C(N)C(S(=O)O)(C)CN1N=NC=C1
Other Names for this Substance
- 1H-1,2,3-Triazole-1-butanoic acid, α-amino-β-methyl-β-sulfino-
- α-Amino-β-methyl-β-sulfino-1H-1,2,3-triazole-1-butanoic acid
- 2-Amino-3-methyl-3-sulfino-4-(1H-1,2,3-triazol-1-yl)butanoic acid
