[2-[(3-cyanothiophen-2-yl)amino]-2-oxoethyl] 3-[[3-(trifluoromethyl)phenyl]sulfonylamino]propanoate
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![[2-[(3-cyanothiophen-2-yl)amino]-2-oxoethyl] 3-[[3-(trifluoromethyl)phenyl]sulfonylamino]propanoate structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220812/27774e93418747a0b0a40d04a0a2763d.png "[2-[(3-cyanothiophen-2-yl)amino]-2-oxoethyl] 3-[[3-(trifluoromethyl)phenyl]sulfonylamino]propanoate")
[2-[(3-cyanothiophen-2-yl)amino]-2-oxoethyl] 3-[[3-(trifluoromethyl)phenyl]sulfonylamino]propanoate
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CAS No:
781624-58-6
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Formula:
C17H14F3N3O5S2
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Chemical Name:
[2-[(3-cyanothiophen-2-yl)amino]-2-oxoethyl] 3-[[3-(trifluoromethyl)phenyl]sulfonylamino]propanoate
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Synonyms:
ZINC3355575;AKOS033432082;MCULE-3003557704;Z15662078;[(3-cyanothiophen-2-yl)carbamoyl]methyl 3-[3-(trifluoromethyl)benzenesulfonamido]propanoate;781624-58-6
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CAS No:
[2-[(3-cyanothiophen-2-yl)amino]-2-oxoethyl] 3-[[3-(trifluoromethyl)phenyl]sulfonylamino]propanoate Basic Attributes
461.4 g/mol
461.03269739 g/mol
Computed Properties
Molecular Weight:461.4
XLogP3:2.8
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:11
Rotatable Bond Count:9
Exact Mass:461.03269739
Monoisotopic Mass:461.03269739
Topological Polar Surface Area:162
Heavy Atom Count:30
Complexity:776
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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