1-[4-(acetylamino)-3-chlorophenyl]-3-methyl-1H-1,2,4-triazolium methyl sulphate
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Product Description
Product
1-[4-(acetylamino)-3-chlorophenyl]-3-methyl-1H-1,2,4-triazolium methyl sulphate
CAS
71501-35-4
Formula
C12H15ClN4O5S; C11H12ClN4O.CH3O4S
Typical Product Specifications
Molecular weight
362.79
EINECS
275-563-0
SMILES
Cc1[nH]c[n+](n1)c2ccc(c(c2)Cl)NC(=O)C.COS(=O)(=O)[O-]
InChI
USTUWOZDXWOJFC-UHFFFAOYSA-N
InChIKey
1S/C11H11ClN4O.CH4O4S/c1-7-13-6-16(15-7)9-3-4-11(10(12)5-9)14-8(2)17;1-5-6(2,3)4/h3-6H,1-2H3,(H,14,17);1H3,(H,2,3,4)
Class
1-[4-(acetylamino)-3-chlorophenyl]-3-methyl-1H-1,2,4-triazolium methyl sulphate
Product Description
Product
1-[4-(acetylamino)-3-chlorophenyl]-3-methyl-1H-1,2,4-triazolium methyl sulphate
CAS
71501-35-4
Formula
C12H15ClN4O5S; C11H12ClN4O.CH3O4S
Typical Product Specifications
Molecular weight
362.79
EINECS
275-563-0
SMILES
Cc1[nH]c[n+](n1)c2ccc(c(c2)Cl)NC(=O)C.COS(=O)(=O)[O-]
InChI
USTUWOZDXWOJFC-UHFFFAOYSA-N
InChIKey
1S/C11H11ClN4O.CH4O4S/c1-7-13-6-16(15-7)9-3-4-11(10(12)5-9)14-8(2)17;1-5-6(2,3)4/h3-6H,1-2H3,(H,14,17);1H3,(H,2,3,4)
Class
