[2-[(3-cyano-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophen-2-yl)amino]-2-oxoethyl] 2-[(2-ethoxybenzoyl)amino]acetate
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![[2-[(3-cyano-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophen-2-yl)amino]-2-oxoethyl] 2-[(2-ethoxybenzoyl)amino]acetate structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220811/280b82776dd443ada89a95bb52deac79.png "[2-[(3-cyano-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophen-2-yl)amino]-2-oxoethyl] 2-[(2-ethoxybenzoyl)amino]acetate")
[2-[(3-cyano-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophen-2-yl)amino]-2-oxoethyl] 2-[(2-ethoxybenzoyl)amino]acetate
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CAS No:
729587-69-3
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Formula:
C23H25N3O5S
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Chemical Name:
[2-[(3-cyano-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophen-2-yl)amino]-2-oxoethyl] 2-[(2-ethoxybenzoyl)amino]acetate
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Synonyms:
ZINC3292637;AKOS033633877;MCULE-5607368913;Z18631242;({3-cyano-4H,5H,6H,7H,8H-cyclohepta[b]thiophen-2-yl}carbamoyl)methyl 2-[(2-ethoxyphenyl)formamido]acetate;729587-69-3
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CAS No:
[2-[(3-cyano-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophen-2-yl)amino]-2-oxoethyl] 2-[(2-ethoxybenzoyl)amino]acetate Basic Attributes
455.5 g/mol
455.15149208 g/mol
Computed Properties
Molecular Weight:455.5
XLogP3:4.4
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:7
Rotatable Bond Count:9
Exact Mass:455.15149208
Monoisotopic Mass:455.15149208
Topological Polar Surface Area:146
Heavy Atom Count:32
Complexity:724
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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