[2-[(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)amino]-2-oxoethyl] 3-hydroxynaphthalene-2-carboxylate
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![[2-[(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)amino]-2-oxoethyl] 3-hydroxynaphthalene-2-carboxylate structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220811/d048d63d2c934c34a5db2cbbd4561b15.png "[2-[(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)amino]-2-oxoethyl] 3-hydroxynaphthalene-2-carboxylate")
[2-[(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)amino]-2-oxoethyl] 3-hydroxynaphthalene-2-carboxylate
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CAS No:
733006-63-8
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Formula:
C22H18N2O4S
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Chemical Name:
[2-[(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)amino]-2-oxoethyl] 3-hydroxynaphthalene-2-carboxylate
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Synonyms:
ZINC3313105;AKOS002507379;MCULE-3422825001;Z19712878;[(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)carbamoyl]methyl 3-hydroxynaphthalene-2-carboxylate;733006-63-8
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CAS No:
[2-[(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)amino]-2-oxoethyl] 3-hydroxynaphthalene-2-carboxylate Basic Attributes
406.5 g/mol
406.09872823 g/mol
Computed Properties
Molecular Weight:406.5
XLogP3:5.6
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:5
Exact Mass:406.09872823
Monoisotopic Mass:406.09872823
Topological Polar Surface Area:128
Heavy Atom Count:29
Complexity:677
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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