[2-[(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)amino]-2-oxoethyl] 1-thiophen-2-ylsulfonylpiperidine-4-carboxylate
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![[2-[(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)amino]-2-oxoethyl] 1-thiophen-2-ylsulfonylpiperidine-4-carboxylate structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220812/b7b7f6064b17484fa159dccaff4a41fb.png "[2-[(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)amino]-2-oxoethyl] 1-thiophen-2-ylsulfonylpiperidine-4-carboxylate")
[2-[(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)amino]-2-oxoethyl] 1-thiophen-2-ylsulfonylpiperidine-4-carboxylate
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CAS No:
733027-10-6
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Formula:
C21H23N3O5S3
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Chemical Name:
[2-[(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)amino]-2-oxoethyl] 1-thiophen-2-ylsulfonylpiperidine-4-carboxylate
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Synonyms:
ZINC3319137;AKOS033653514;MCULE-6922438897;Z18993370;[(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)carbamoyl]methyl 1-(thiophene-2-sulfonyl)piperidine-4-carboxylate;733027-10-6
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CAS No:
[2-[(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)amino]-2-oxoethyl] 1-thiophen-2-ylsulfonylpiperidine-4-carboxylate Basic Attributes
493.6 g/mol
493.07998436 g/mol
Computed Properties
Molecular Weight:493.6
XLogP3:3.8
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:9
Rotatable Bond Count:7
Exact Mass:493.07998436
Monoisotopic Mass:493.07998436
Topological Polar Surface Area:181
Heavy Atom Count:32
Complexity:860
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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