[2-[(3-cyanothiophen-2-yl)amino]-2-oxoethyl] 2-(2,5-dimethylphenyl)-1,3-dioxoisoindole-5-carboxylate
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![[2-[(3-cyanothiophen-2-yl)amino]-2-oxoethyl] 2-(2,5-dimethylphenyl)-1,3-dioxoisoindole-5-carboxylate structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220811/8c9065d03a7e43a2be36e06b9dc22fc0.png "[2-[(3-cyanothiophen-2-yl)amino]-2-oxoethyl] 2-(2,5-dimethylphenyl)-1,3-dioxoisoindole-5-carboxylate")
[2-[(3-cyanothiophen-2-yl)amino]-2-oxoethyl] 2-(2,5-dimethylphenyl)-1,3-dioxoisoindole-5-carboxylate
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CAS No:
736935-51-6
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Formula:
C24H17N3O5S
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Chemical Name:
[2-[(3-cyanothiophen-2-yl)amino]-2-oxoethyl] 2-(2,5-dimethylphenyl)-1,3-dioxoisoindole-5-carboxylate
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Synonyms:
ZINC3297512;AKOS002441026;MCULE-8643222121;Z15422545;[(3-cyanothiophen-2-yl)carbamoyl]methyl 2-(2,5-dimethylphenyl)-1,3-dioxo-2,3-dihydro-1H-isoindole-5-carboxylate;736935-51-6
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CAS No:
[2-[(3-cyanothiophen-2-yl)amino]-2-oxoethyl] 2-(2,5-dimethylphenyl)-1,3-dioxoisoindole-5-carboxylate Basic Attributes
459.5 g/mol
459.08889182 g/mol
Computed Properties
Molecular Weight:459.5
XLogP3:4.2
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:7
Rotatable Bond Count:6
Exact Mass:459.08889182
Monoisotopic Mass:459.08889182
Topological Polar Surface Area:145
Heavy Atom Count:33
Complexity:869
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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