[2-[(3-cyanothiophen-2-yl)amino]-2-oxoethyl] 4-iodobenzoate
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![[2-[(3-cyanothiophen-2-yl)amino]-2-oxoethyl] 4-iodobenzoate structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220811/6de4e438aeff4d3a8920c7fcce502693.png "[2-[(3-cyanothiophen-2-yl)amino]-2-oxoethyl] 4-iodobenzoate")
[2-[(3-cyanothiophen-2-yl)amino]-2-oxoethyl] 4-iodobenzoate
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CAS No:
731823-25-9
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Formula:
C14H9IN2O3S
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Chemical Name:
[2-[(3-cyanothiophen-2-yl)amino]-2-oxoethyl] 4-iodobenzoate
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Synonyms:
ZINC3295965;AKOS033707195;MCULE-8620584716;Z19776092;[(3-cyanothiophen-2-yl)carbamoyl]methyl 4-iodobenzoate;731823-25-9
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CAS No:
[2-[(3-cyanothiophen-2-yl)amino]-2-oxoethyl] 4-iodobenzoate Basic Attributes
412.20 g/mol
411.93786 g/mol
Computed Properties
Molecular Weight:412.20
XLogP3:3.6
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:5
Exact Mass:411.93786
Monoisotopic Mass:411.93786
Topological Polar Surface Area:107
Heavy Atom Count:21
Complexity:443
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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