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Home >> Chemical Listing >> Page 1763 >> 4-Chloro-3-({[3-(3-Nitrophenyl)Acryloyl]Carbamothioyl}Amino)Benzoic Acid

4-Chloro-3-({[3-(3-Nitrophenyl)Acryloyl]Carbamothioyl}Amino)Benzoic Acid
[CAS# 535965-35-6]

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Identification
Name 4-Chloro-3-({[3-(3-Nitrophenyl)Acryloyl]Carbamothioyl}Amino)Benzoic Acid
Molecular Structure CAS#: 535965-35-6, 4-Chloro-3-({[3-(3-Nitrophenyl)Acryloyl]Carbamothioyl}Amino)Benzoic Acid
Molecular Formula C17H12ClN3O5S
Molecular Weight 405.81
CAS Registry Number 535965-35-6
SMILES Clc2ccc(cc2NC(=S)NC(=O)C=Cc1cccc([N+]([O-])=O)c1)C(=O)O
InChI 1S/C17H12ClN3O5S/c18-13-6-5-11(16(23)24)9-14(13)19-17(27)20-15(22)7-4-10-2-1-3-12(8-10)21(25)26/h1-9H,(H,23,24)(H2,19,20,22,27)
InChIKey FVENUUMMAXEEOU-UHFFFAOYSA-N
Properties
Density 1.573g/cm3 (Cal.)
Refractive index 1.751 (Cal.)
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