[2-(3-chloro-4-methylanilino)-2-oxoethyl] 2-acetamido-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
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![[2-(3-chloro-4-methylanilino)-2-oxoethyl] 2-acetamido-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220812/438669acdbbc4c2caa2bb5b5d7751c58.png "[2-(3-chloro-4-methylanilino)-2-oxoethyl] 2-acetamido-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate")
[2-(3-chloro-4-methylanilino)-2-oxoethyl] 2-acetamido-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
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CAS No:
561002-80-0
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Formula:
C20H21ClN2O4S
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Chemical Name:
[2-(3-chloro-4-methylanilino)-2-oxoethyl] 2-acetamido-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
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Synonyms:
ZINC3347344;AKOS033771957;MCULE-9390258922;Z21466086;[(3-chloro-4-methylphenyl)carbamoyl]methyl 2-acetamido-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate;561002-80-0
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CAS No:
[2-(3-chloro-4-methylanilino)-2-oxoethyl] 2-acetamido-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate Basic Attributes
420.9 g/mol
420.0910560 g/mol
Computed Properties
Molecular Weight:420.9
XLogP3:4.6
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:6
Exact Mass:420.0910560
Monoisotopic Mass:420.0910560
Topological Polar Surface Area:113
Heavy Atom Count:28
Complexity:605
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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