6-(azepan-1-yl)-5-[(Z)-[3-(3-ethoxypropyl)-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene]methyl]-1,4-dimethyl-2-oxopyridine-3-carbonitrile
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![6-(azepan-1-yl)-5-[(Z)-[3-(3-ethoxypropyl)-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene]methyl]-1,4-dimethyl-2-oxopyridine-3-carbonitrile structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220811/f85fdd0f97654944bc5f84f0e6e459fe.png "6-(azepan-1-yl)-5-[(Z)-[3-(3-ethoxypropyl)-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene]methyl]-1,4-dimethyl-2-oxopyridine-3-carbonitrile")
6-(azepan-1-yl)-5-[(Z)-[3-(3-ethoxypropyl)-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene]methyl]-1,4-dimethyl-2-oxopyridine-3-carbonitrile
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CAS No:
619268-56-3
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Formula:
C23H30N4O3S2
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Chemical Name:
6-(azepan-1-yl)-5-[(Z)-[3-(3-ethoxypropyl)-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene]methyl]-1,4-dimethyl-2-oxopyridine-3-carbonitrile
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Synonyms:
ZINC2238316;STK569855;AKOS002712370;(Z)-6-(azepan-1-yl)-5-((3-(3-ethoxypropyl)-4-oxo-2-thioxothiazolidin-5-ylidene)methyl)-1,4-dimethyl-2-oxo-1,2-dihydropyridine-3-carbonitrile;6-(azepan-1-yl)-5-{(Z)-[3-(3-ethoxypropyl)-4-oxo-2-thioxo-1,3-thiazolidin-5-ylidene]methyl}-1,4-dimethyl-2-oxo-1,2-dihydropyridine-3-carbonitrile;619268-56-3
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CAS No:
6-(azepan-1-yl)-5-[(Z)-[3-(3-ethoxypropyl)-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene]methyl]-1,4-dimethyl-2-oxopyridine-3-carbonitrile Basic Attributes
474.6 g/mol
474.17593318 g/mol
Computed Properties
Molecular Weight:474.6
XLogP3:3
Hydrogen Bond Acceptor Count:7
Rotatable Bond Count:7
Exact Mass:474.17593318
Monoisotopic Mass:474.17593318
Topological Polar Surface Area:134
Heavy Atom Count:32
Complexity:936
Defined Bond Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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