515-57-1
MALEYLSULFATHIAZOLE
Name
MALEYLSULFATHIAZOLE
Formula
C13 H11 N3 O5 S2
MolWeight
353.378
1Identification
【Name】
MALEYLSULFATHIAZOLE
【CAS】
【MDL】
MFCD00868953
【English Synonyms】
【Formula】
C13 H11 N3 O5 S2
【MolWeight】
353.378
【Inchi】
InChI=1S/C13H11N3O5S2/c17-11(5-6-12(18)19)15-9-1-3-10(4-2-9)23(20,21)16-13-14-7-8-22-13/h1-8H,(H,14,16)(H,15,17)(H,18,19)/b6-5-
【InChIKey】
InChIKey=ALXRUJOUFGNSHT-WAYWQWQTSA-N
【SMILES】
c1cc(ccc1NC(=O)/C=C\C(=O)O)S(=O)(=O)Nc2nccs2
【MOL File】
2Chemical and Physical Properties
【Computed Properties】
H bond donor:3
H bond acceptor:8
XLogP3:1.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
MALEYLSULFATHIAZOLE.cml
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