[2-oxo-2-[(4-phenyl-1,3-thiazol-2-yl)amino]ethyl] 4-[(4-methyl-1,2,4-triazol-3-yl)sulfanyl]-3-nitrobenzoate
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![[2-oxo-2-[(4-phenyl-1,3-thiazol-2-yl)amino]ethyl] 4-[(4-methyl-1,2,4-triazol-3-yl)sulfanyl]-3-nitrobenzoate structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220811/e612b66d815d4152985edbdd25d8ce20.png "[2-oxo-2-[(4-phenyl-1,3-thiazol-2-yl)amino]ethyl] 4-[(4-methyl-1,2,4-triazol-3-yl)sulfanyl]-3-nitrobenzoate")
[2-oxo-2-[(4-phenyl-1,3-thiazol-2-yl)amino]ethyl] 4-[(4-methyl-1,2,4-triazol-3-yl)sulfanyl]-3-nitrobenzoate
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CAS No:
436815-70-2
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Formula:
C21H16N6O5S2
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Chemical Name:
[2-oxo-2-[(4-phenyl-1,3-thiazol-2-yl)amino]ethyl] 4-[(4-methyl-1,2,4-triazol-3-yl)sulfanyl]-3-nitrobenzoate
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Synonyms:
ZINC3254714;AKOS033667820;MCULE-4516648296;Z19254622;[(4-phenyl-1,3-thiazol-2-yl)carbamoyl]methyl 4-[(4-methyl-4H-1,2,4-triazol-3-yl)sulfanyl]-3-nitrobenzoate;436815-70-2
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CAS No:
[2-oxo-2-[(4-phenyl-1,3-thiazol-2-yl)amino]ethyl] 4-[(4-methyl-1,2,4-triazol-3-yl)sulfanyl]-3-nitrobenzoate Basic Attributes
496.5 g/mol
496.06235998 g/mol
Computed Properties
Molecular Weight:496.5
XLogP3:3.4
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:10
Rotatable Bond Count:8
Exact Mass:496.06235998
Monoisotopic Mass:496.06235998
Topological Polar Surface Area:198
Heavy Atom Count:34
Complexity:737
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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