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[2-(ethoxycarbonylamino)-2-oxoethyl] 3-nitro-4-(1H-1,2,4-triazol-5-ylsulfanyl)benzoate

[2-(ethoxycarbonylamino)-2-oxoethyl] 3-nitro-4-(1H-1,2,4-triazol-5-ylsulfanyl)benzoate structure

CAS No:
743469-93-4
Formula:
C14H13N5O7S
Chemical Name:
[2-(ethoxycarbonylamino)-2-oxoethyl] 3-nitro-4-(1H-1,2,4-triazol-5-ylsulfanyl)benzoate
Synonyms:
MLS001004551;SMR000348099;CHEMBL1595557;BDBM55142;cid_2083851;HMS2696N19;ZINC12733366;MCULE-4948501477;[2-(ethoxycarbonylamino)-2-oxoethyl] 3-nitro-4-(1H-1,2,4-triazol-5-ylsulfanyl)benzoate;Z22832177;2-[(ethoxycarbonyl)amino]-2-oxoethyl 3-nitro-4-(4H-1,2,4-triazol-3-ylsulfanyl)benzoate;[2-(ethoxycarbonylamino)-2-oxidanylidene-ethyl] 3-nitro-4-(1H-1,2,4-triazol-5-ylsulfanyl)benzoate;3-nitro-4-(1H-1,2,4-triazol-5-ylthio)benzoic acid [2-(carbethoxyamino)-2-keto-ethyl] ester;3-nitro-4-(1H-1,2,4-triazol-5-ylthio)benzoic acid [2-(ethoxycarbonylamino)-2-oxoethyl] ester;743469-93-4

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[2-(ethoxycarbonylamino)-2-oxoethyl] 3-nitro-4-(1H-1,2,4-triazol-5-ylsulfanyl)benzoate Basic Attributes

Molecular Weight：

395.35 g/mol

Exact Mass：

395.05356894 g/mol

Characteristics

PSA：

194 Å²

Computed Properties

Molecular Weight:395.35
XLogP3:2
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:10
Rotatable Bond Count:8
Exact Mass:395.05356894
Monoisotopic Mass:395.05356894
Topological Polar Surface Area:194
Heavy Atom Count:27
Complexity:573
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of [2-(ethoxycarbonylamino)-2-oxoethyl] 3-nitro-4-(1H-1,2,4-triazol-5-ylsulfanyl)benzoate

Basic Attributes
Characteristics
Computed Properties
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