3-[[2-[(4-methyl-1,2,4-triazol-3-yl)sulfanyl]acetyl]amino]benzoic acid
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![3-[[2-[(4-methyl-1,2,4-triazol-3-yl)sulfanyl]acetyl]amino]benzoic acid structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220811/88acfbedba0a49d7875a8ba54fca396b.png "3-[[2-[(4-methyl-1,2,4-triazol-3-yl)sulfanyl]acetyl]amino]benzoic acid")
3-[[2-[(4-methyl-1,2,4-triazol-3-yl)sulfanyl]acetyl]amino]benzoic acid
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CAS No:
511284-39-2
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Formula:
C12H12N4O3S
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Chemical Name:
3-[[2-[(4-methyl-1,2,4-triazol-3-yl)sulfanyl]acetyl]amino]benzoic acid
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Synonyms:
3-{2-[(4-methyl-4H-1,2,4-triazol-3-yl)sulfanyl]acetamido}benzoic acid;511284-39-2;3-[2-(4-Methyl-4H-[1,2,4]triazol-3-ylsulfanyl)-acetylamino]-benzoic acid;MLS000564197;CHEMBL1430782;HMS2420L05;ZINC3269560;MFCD03771461;STL182743;3-[[2-[(4-methyl-1,2,4-triazol-3-yl)sulfanyl]acetyl]amino]benzoic acid;AKOS000118689;MCULE-9926684630;NE18429;SMR000151675;EN300-04989;SR-01000039626;SR-01000039626-1;Z19813893;3-({[(4-methyl-4H-1,2,4-triazol-3-yl)sulfanyl]acetyl}amino)benzoic acid;3-[2-(4-Methyl-4H-[1,2,4]triazol-3-ylsulfanyl)acetylamino]benzoic acid
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CAS No:
3-[[2-[(4-methyl-1,2,4-triazol-3-yl)sulfanyl]acetyl]amino]benzoic acid Basic Attributes
292.32 g/mol
292.06301143 g/mol
Computed Properties
Molecular Weight:292.32
XLogP3:0.7
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:5
Exact Mass:292.06301143
Monoisotopic Mass:292.06301143
Topological Polar Surface Area:122
Heavy Atom Count:20
Complexity:369
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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