2-[[4-cyano-3-[2-oxo-2-(1,3-thiazol-2-ylamino)ethyl]sulfanyl-1,2-thiazol-5-yl]sulfanyl]-N-(1,3-thiazol-2-yl)acetamide
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2-[[4-cyano-3-[2-oxo-2-(1,3-thiazol-2-ylamino)ethyl]sulfanyl-1,2-thiazol-5-yl]sulfanyl]-N-(1,3-thiazol-2-yl)acetamide
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CAS No:
329934-69-2
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Formula:
C14H10N6O2S5
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Chemical Name:
2-[[4-cyano-3-[2-oxo-2-(1,3-thiazol-2-ylamino)ethyl]sulfanyl-1,2-thiazol-5-yl]sulfanyl]-N-(1,3-thiazol-2-yl)acetamide
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Synonyms:
2,2'-[(4-cyano-1,2-thiazole-3,5-diyl)disulfanediyl]bis[N-(1,3-thiazol-2-yl)acetamide];Oprea1_267850;Salor-int l224103-1ea;HMS1610C02;ZINC2269437;STK040703;AKOS001617196;MCULE-3717508612;ST009750;SR-01000434270;SR-01000434270-1;2-[(4-CYANO-3-{[2-OXO-2-(1,3-THIAZOL-2-YLAMINO)ETHYL]SULFANYL}-5-ISOTHIAZOLYL)SULFANYL]-N-(1,3-THIAZOL-2-YL)ACETAMIDE;2-[(4-cyano-3-{[2-oxo-2-(1,3-thiazol-2-ylamino)ethyl]thio}isothiazol-5-yl)thio]-N-1,3-thiazol-2-ylacetamide;2-{4-cyano-3-[(N-(1,3-thiazol-2-yl)carbamoyl)methylthio]isothiazol-5-ylthio}-N -(1,3-thiazol-2-yl)acetamide;329934-69-2
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CAS No:
2-[[4-cyano-3-[2-oxo-2-(1,3-thiazol-2-ylamino)ethyl]sulfanyl-1,2-thiazol-5-yl]sulfanyl]-N-(1,3-thiazol-2-yl)acetamide Basic Attributes
454.6 g/mol
453.94687945 g/mol
Safety Information
|Warning|H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]|P264, P270, P280, P301+P312, P305+P351+P338, P330, P337+P313, and P501|Aggregated GHS information provided by 38 companies from 1 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Computed Properties
Molecular Weight:454.6
XLogP3:2.9
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:11
Rotatable Bond Count:8
Exact Mass:453.94687945
Monoisotopic Mass:453.94687945
Topological Polar Surface Area:256
Heavy Atom Count:27
Complexity:590
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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