[2-[(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)amino]-2-oxoethyl] 2-[(4-fluorobenzoyl)amino]acetate
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![[2-[(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)amino]-2-oxoethyl] 2-[(4-fluorobenzoyl)amino]acetate structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220812/b7d55d1f2c444df1aa492f5f9bcba8f9.png "[2-[(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)amino]-2-oxoethyl] 2-[(4-fluorobenzoyl)amino]acetate")
[2-[(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)amino]-2-oxoethyl] 2-[(4-fluorobenzoyl)amino]acetate
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CAS No:
731775-58-9
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Formula:
C20H18FN3O4S
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Chemical Name:
[2-[(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)amino]-2-oxoethyl] 2-[(4-fluorobenzoyl)amino]acetate
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Synonyms:
ZINC3318348;AKOS033735437;MCULE-1469194581;Z20187519;[(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)carbamoyl]methyl 2-[(4-fluorophenyl)formamido]acetate;731775-58-9
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CAS No:
[2-[(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)amino]-2-oxoethyl] 2-[(4-fluorobenzoyl)amino]acetate Basic Attributes
415.4 g/mol
415.10020540 g/mol
Computed Properties
Molecular Weight:415.4
XLogP3:3.6
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:7
Rotatable Bond Count:7
Exact Mass:415.10020540
Monoisotopic Mass:415.10020540
Topological Polar Surface Area:137
Heavy Atom Count:29
Complexity:674
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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