[2-[(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)amino]-2-oxoethyl] 3-chloro-1-benzothiophene-2-carboxylate
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![[2-[(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)amino]-2-oxoethyl] 3-chloro-1-benzothiophene-2-carboxylate structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220811/4d18686ea2b045f0a316ca6d448d4b82.png "[2-[(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)amino]-2-oxoethyl] 3-chloro-1-benzothiophene-2-carboxylate")
[2-[(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)amino]-2-oxoethyl] 3-chloro-1-benzothiophene-2-carboxylate
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CAS No:
561048-12-2
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Formula:
C20H15ClN2O3S2
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Chemical Name:
[2-[(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)amino]-2-oxoethyl] 3-chloro-1-benzothiophene-2-carboxylate
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Synonyms:
ZINC3345093;AKOS000863336;MCULE-3549973165;Z18784492;[(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)carbamoyl]methyl 3-chloro-1-benzothiophene-2-carboxylate;561048-12-2
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CAS No:
[2-[(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)amino]-2-oxoethyl] 3-chloro-1-benzothiophene-2-carboxylate Basic Attributes
430.9 g/mol
430.0212624 g/mol
Computed Properties
Molecular Weight:430.9
XLogP3:6.2
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:5
Exact Mass:430.0212624
Monoisotopic Mass:430.0212624
Topological Polar Surface Area:136
Heavy Atom Count:28
Complexity:669
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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