[2-[(3-cyano-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophen-2-yl)amino]-2-oxoethyl] 3-(furan-2-carbonylamino)-4-methylbenzoate
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![[2-[(3-cyano-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophen-2-yl)amino]-2-oxoethyl] 3-(furan-2-carbonylamino)-4-methylbenzoate structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220812/b7792ae3beae457db9d52bc58aad8ae8.png "[2-[(3-cyano-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophen-2-yl)amino]-2-oxoethyl] 3-(furan-2-carbonylamino)-4-methylbenzoate")
[2-[(3-cyano-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophen-2-yl)amino]-2-oxoethyl] 3-(furan-2-carbonylamino)-4-methylbenzoate
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CAS No:
736957-25-8
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Formula:
C25H23N3O5S
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Chemical Name:
[2-[(3-cyano-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophen-2-yl)amino]-2-oxoethyl] 3-(furan-2-carbonylamino)-4-methylbenzoate
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Synonyms:
SMR000066348;MLS000056797;MLS000881088;CHEMBL1335963;HMS2164D15;HMS3316O04;ZINC3248172;AKOS033671232;MCULE-3332283448;Z19287470;({3-cyano-4H,5H,6H,7H,8H-cyclohepta[b]thiophen-2-yl}carbamoyl)methyl 3-(furan-2-amido)-4-methylbenzoate;736957-25-8
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CAS No:
[2-[(3-cyano-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophen-2-yl)amino]-2-oxoethyl] 3-(furan-2-carbonylamino)-4-methylbenzoate Basic Attributes
477.5 g/mol
477.13584202 g/mol
Computed Properties
Molecular Weight:477.5
XLogP3:5.3
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:7
Rotatable Bond Count:7
Exact Mass:477.13584202
Monoisotopic Mass:477.13584202
Topological Polar Surface Area:150
Heavy Atom Count:34
Complexity:814
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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