methyl 2-benzamido-2-[(3-cyano-4-ethyl-5-methylthiophen-2-yl)amino]-3,3,3-trifluoropropanoate
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![methyl 2-benzamido-2-[(3-cyano-4-ethyl-5-methylthiophen-2-yl)amino]-3,3,3-trifluoropropanoate structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220812/01846f811d3444ffb431f5418eebfc0a.png "methyl 2-benzamido-2-[(3-cyano-4-ethyl-5-methylthiophen-2-yl)amino]-3,3,3-trifluoropropanoate")
methyl 2-benzamido-2-[(3-cyano-4-ethyl-5-methylthiophen-2-yl)amino]-3,3,3-trifluoropropanoate
structure -
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CAS No:
374101-57-2
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Formula:
C19H18F3N3O3S
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Chemical Name:
methyl 2-benzamido-2-[(3-cyano-4-ethyl-5-methylthiophen-2-yl)amino]-3,3,3-trifluoropropanoate
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Synonyms:
STK763369;AKOS001627154;MCULE-2670939462;UNM000000575801;SR-01000452839;SR-01000452839-1;methyl 2-(benzoylamino)-N-(3-cyano-4-ethyl-5-methylthien-2-yl)-3,3,3-trifluoroalaninate;374101-57-2;Methyl 2-(benzoylamino)-2-[(3-cyano-4-ethyl-5-methyl-2-thienyl)amino]-3,3,3-trifluoropropanoate #;methyl N-(3-cyano-4-ethyl-5-methylthiophen-2-yl)-3,3,3-trifluoro-2-[(phenylcarbonyl)amino]alaninate;Propanoic acid, 2-benzoylamino-2-(3-cyano-4-ethyl-5-methyl-2-thienylamino)-3,3,3-trifluoro-, methyl ester
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CAS No:
methyl 2-benzamido-2-[(3-cyano-4-ethyl-5-methylthiophen-2-yl)amino]-3,3,3-trifluoropropanoate Basic Attributes
425.4 g/mol
425.10209710 g/mol
Computed Properties
Molecular Weight:425.4
XLogP3:5.3
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:9
Rotatable Bond Count:7
Exact Mass:425.10209710
Monoisotopic Mass:425.10209710
Topological Polar Surface Area:120
Heavy Atom Count:29
Complexity:660
Undefined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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