[2-[N-(2-cyanoethyl)-2-methoxyanilino]-2-oxoethyl] 3-oxo-4H-1,4-benzothiazine-6-carboxylate
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![[2-[N-(2-cyanoethyl)-2-methoxyanilino]-2-oxoethyl] 3-oxo-4H-1,4-benzothiazine-6-carboxylate structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220812/6228bd59d3a849c891e2a61417e26fec.png "[2-[N-(2-cyanoethyl)-2-methoxyanilino]-2-oxoethyl] 3-oxo-4H-1,4-benzothiazine-6-carboxylate")
[2-[N-(2-cyanoethyl)-2-methoxyanilino]-2-oxoethyl] 3-oxo-4H-1,4-benzothiazine-6-carboxylate
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CAS No:
783309-41-1
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Formula:
C21H19N3O5S
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Chemical Name:
[2-[N-(2-cyanoethyl)-2-methoxyanilino]-2-oxoethyl] 3-oxo-4H-1,4-benzothiazine-6-carboxylate
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Synonyms:
ZINC3361438;AKOS033474610;MCULE-1308790268;SR-01000057921;SR-01000057921-1;Z16219118;[(2-cyanoethyl)(2-methoxyphenyl)carbamoyl]methyl 3-oxo-3,4-dihydro-2H-1,4-benzothiazine-6-carboxylate;783309-41-1
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CAS No:
[2-[N-(2-cyanoethyl)-2-methoxyanilino]-2-oxoethyl] 3-oxo-4H-1,4-benzothiazine-6-carboxylate Basic Attributes
425.5 g/mol
425.10454189 g/mol
Computed Properties
Molecular Weight:425.5
XLogP3:2
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:7
Rotatable Bond Count:8
Exact Mass:425.10454189
Monoisotopic Mass:425.10454189
Topological Polar Surface Area:134
Heavy Atom Count:30
Complexity:693
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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