ethyl 4,5-dimethyl-2-[[2-[[5-(3-methylphenyl)-1H-1,2,4-triazol-3-yl]sulfanyl]acetyl]amino]thiophene-3-carboxylate
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ethyl 4,5-dimethyl-2-[[2-[[5-(3-methylphenyl)-1H-1,2,4-triazol-3-yl]sulfanyl]acetyl]amino]thiophene-3-carboxylate
structure -
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CAS No:
332158-87-9
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Formula:
C20H22N4O3S2
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Chemical Name:
ethyl 4,5-dimethyl-2-[[2-[[5-(3-methylphenyl)-1H-1,2,4-triazol-3-yl]sulfanyl]acetyl]amino]thiophene-3-carboxylate
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Synonyms:
332158-87-9;ZINC2064035;AKOS000574362;MCULE-7428367092;4,5-Dimethyl-2-[2-(5-m-tolyl-2H-[1,2,4]triazol-3-ylsulfanyl)-acetylamino]-thiophene-3-carboxylic acid ethyl ester;Ethyl 4,5-dimethyl-2-(2-((3-(m-tolyl)-1H-1,2,4-triazol-5-yl)thio)acetamido)thiophene-3-carboxylate
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CAS No:
ethyl 4,5-dimethyl-2-[[2-[[5-(3-methylphenyl)-1H-1,2,4-triazol-3-yl]sulfanyl]acetyl]amino]thiophene-3-carboxylate Basic Attributes
430.5 g/mol
430.11333292 g/mol
Computed Properties
Molecular Weight:430.5
XLogP3:5.3
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:7
Rotatable Bond Count:8
Exact Mass:430.11333292
Monoisotopic Mass:430.11333292
Topological Polar Surface Area:151
Heavy Atom Count:29
Complexity:582
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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