2-[(4-ethoxy-3-nitrobenzoyl)carbamothioylamino]benzoic acid
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![2-[(4-ethoxy-3-nitrobenzoyl)carbamothioylamino]benzoic acid structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220812/6aa4d5f90cbe430399fd72368b5c1b94.png "2-[(4-ethoxy-3-nitrobenzoyl)carbamothioylamino]benzoic acid")
2-[(4-ethoxy-3-nitrobenzoyl)carbamothioylamino]benzoic acid
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CAS No:
433971-97-2
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Formula:
C17H15N3O6S
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Chemical Name:
2-[(4-ethoxy-3-nitrobenzoyl)carbamothioylamino]benzoic acid
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Synonyms:
2-({[(4-ethoxy-3-nitrophenyl)carbonyl]carbamothioyl}amino)benzoic acid;Oprea1_619743;ZINC3000055;BBL009545;MFCD03243926;STK102270;AKOS000289221;MCULE-9930549429;SR-01000248353;SR-01000248353-1;433971-97-2
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CAS No:
2-[(4-ethoxy-3-nitrobenzoyl)carbamothioylamino]benzoic acid Basic Attributes
389.4 g/mol
389.06815638 g/mol
Computed Properties
Molecular Weight:389.4
XLogP3:3.2
Hydrogen Bond Donor Count:3
Hydrogen Bond Acceptor Count:7
Rotatable Bond Count:5
Exact Mass:389.06815638
Monoisotopic Mass:389.06815638
Topological Polar Surface Area:166
Heavy Atom Count:27
Complexity:582
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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