[2-oxo-2-(1H-pyrrol-2-yl)ethyl] 2-acetamido-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
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![[2-oxo-2-(1H-pyrrol-2-yl)ethyl] 2-acetamido-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220811/33588f5b9dd647c5bde5b6d96953e0d8.png "[2-oxo-2-(1H-pyrrol-2-yl)ethyl] 2-acetamido-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate")
[2-oxo-2-(1H-pyrrol-2-yl)ethyl] 2-acetamido-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
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CAS No:
796066-29-0
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Formula:
C17H18N2O4S
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Chemical Name:
[2-oxo-2-(1H-pyrrol-2-yl)ethyl] 2-acetamido-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
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Synonyms:
ZINC3338361;AKOS033771811;MCULE-6936318139;Z21461857;2-oxo-2-(1H-pyrrol-2-yl)ethyl 2-acetamido-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate;796066-29-0
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CAS No:
[2-oxo-2-(1H-pyrrol-2-yl)ethyl] 2-acetamido-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate Basic Attributes
346.4 g/mol
346.09872823 g/mol
Computed Properties
Molecular Weight:346.4
XLogP3:3.3
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:6
Exact Mass:346.09872823
Monoisotopic Mass:346.09872823
Topological Polar Surface Area:117
Heavy Atom Count:24
Complexity:513
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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