methyl 2-[[4-methyl-5-[[(4-nitrobenzoyl)amino]methyl]-1,2,4-triazol-3-yl]sulfanyl]acetate
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methyl 2-[[4-methyl-5-[[(4-nitrobenzoyl)amino]methyl]-1,2,4-triazol-3-yl]sulfanyl]acetate
structure -
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CAS No:
689749-61-9
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Formula:
C14H15N5O5S
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Chemical Name:
methyl 2-[[4-methyl-5-[[(4-nitrobenzoyl)amino]methyl]-1,2,4-triazol-3-yl]sulfanyl]acetate
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Synonyms:
689749-61-9;methyl 2-((4-methyl-5-((4-nitrobenzamido)methyl)-4H-1,2,4-triazol-3-yl)thio)acetate;methyl 2-[(4-methyl-5-{[(4-nitrophenyl)formamido]methyl}-4H-1,2,4-triazol-3-yl)sulfanyl]acetate;Methyl 2-[[4-methyl-5-[[(4-nitrobenzoyl)amino]methyl]-1,2,4-triazol-3-yl]sulfanyl]acetate;ZINC2724049;AKOS024586381;MCULE-4450370701;SR-01000094171;SR-01000094171-1;F0601-0065
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CAS No:
methyl 2-[[4-methyl-5-[[(4-nitrobenzoyl)amino]methyl]-1,2,4-triazol-3-yl]sulfanyl]acetate Basic Attributes
365.37 g/mol
365.07938977 g/mol
Computed Properties
Molecular Weight:365.37
XLogP3:0.8
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:8
Rotatable Bond Count:7
Exact Mass:365.07938977
Monoisotopic Mass:365.07938977
Topological Polar Surface Area:157
Heavy Atom Count:25
Complexity:495
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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