methyl 4,5-dimethyl-2-[[2-([1,2,4]triazolo[3,4-b][1,3]benzothiazol-1-ylsulfanyl)acetyl]amino]thiophene-3-carboxylate
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methyl 4,5-dimethyl-2-[[2-([1,2,4]triazolo[3,4-b][1,3]benzothiazol-1-ylsulfanyl)acetyl]amino]thiophene-3-carboxylate
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CAS No:
379253-86-8
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Formula:
C18H16N4O3S3
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Chemical Name:
methyl 4,5-dimethyl-2-[[2-([1,2,4]triazolo[3,4-b][1,3]benzothiazol-1-ylsulfanyl)acetyl]amino]thiophene-3-carboxylate
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Synonyms:
methyl 4,5-dimethyl-2-{[([1,2,4]triazolo[3,4-b][1,3]benzothiazol-3-ylsulfanyl)acetyl]amino}-3-thiophenecarboxylate;ZINC1801758;CCG-21865;STL306233;AKOS001028946;MCULE-4625374665;methyl 4,5-dimethyl-2-(2-{7-thia-2,4,5-triazatricyclo[6.4.0.0^{2,6}]dodeca-1(8),3,5,9,11-pentaen-3-ylsulfanyl}acetamido)thiophene-3-carboxylate;EU-0080290;ST50051221;AB00721783-01;AF-399/15539266;SR-01000111056;SR-01000111056-1;Z20238162;379253-86-8;methyl 2-(2-(4-hydro-1,2,4-triazolo[3,4-b]benzothiazol-3-ylthio)acetylamino)-4 ,5-dimethylthiophene-3-carboxylate;methyl 4,5-dimethyl-2-{[([1,2,4]triazolo[3,4-b][1,3]benzothiazol-3-ylsulfanyl)acetyl]amino}thiophene-3-carboxylate;methyl 4,5-dimethyl-2-{[([1,2,4]triazolo[3,4-b][1,3]benzothiazol-3-ylthio)acetyl]amino}thiophene-3-carboxylate
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CAS No:
methyl 4,5-dimethyl-2-[[2-([1,2,4]triazolo[3,4-b][1,3]benzothiazol-1-ylsulfanyl)acetyl]amino]thiophene-3-carboxylate Basic Attributes
432.5 g/mol
432.03845391 g/mol
Computed Properties
Molecular Weight:432.5
XLogP3:5.6
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:8
Rotatable Bond Count:6
Exact Mass:432.03845391
Monoisotopic Mass:432.03845391
Topological Polar Surface Area:167
Heavy Atom Count:28
Complexity:613
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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