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2-{[(Phenoxyacetyl)Carbamothioyl]Amino}Benzoic Acid
[CAS# 157921-79-4]

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CAS#: 157921-79-4
Product: 2-{[(Phenoxyacetyl)Carbamothioyl]Amino}Benzoic Acid
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Identification
Name 2-{[(Phenoxyacetyl)Carbamothioyl]Amino}Benzoic Acid
Molecular Structure CAS#: 157921-79-4, 2-{[(Phenoxyacetyl)Carbamothioyl]Amino}Benzoic Acid
Molecular Formula C16H14N2O4S
Molecular Weight 330.36
CAS Registry Number 157921-79-4
SMILES O=C(O)c1ccccc1NC(=S)NC(=O)COc2ccccc2
InChI 1S/C16H14N2O4S/c19-14(10-22-11-6-2-1-3-7-11)18-16(23)17-13-9-5-4-8-12(13)15(20)21/h1-9H,10H2,(H,20,21)(H2,17,18,19,23)
InChIKey YRCDLBWYFVQHKY-UHFFFAOYSA-N
Properties
Density 1.413g/cm3 (Cal.)
Refractive index 1.689 (Cal.)
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