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4-{[(3-Isobutoxybenzoyl)Carbamothioyl]Amino}Benzoic Acid
[CAS# 532387-58-9]

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Identification
Name 4-{[(3-Isobutoxybenzoyl)Carbamothioyl]Amino}Benzoic Acid
Synonyms 4-[({[3-(2-methylpropoxy)phenyl]carbonyl}carbamothioyl)amino]benzoic acid
Molecular Structure CAS#: 532387-58-9, 4-{[(3-Isobutoxybenzoyl)Carbamothioyl]Amino}Benzoic Acid
Molecular Formula C19H20N2O4S
Molecular Weight 372.44
CAS Registry Number 532387-58-9
SMILES O=C(O)c1ccc(cc1)NC(=S)NC(=O)c2cc(OCC(C)C)ccc2
InChI 1S/C19H20N2O4S/c1-12(2)11-25-16-5-3-4-14(10-16)17(22)21-19(26)20-15-8-6-13(7-9-15)18(23)24/h3-10,12H,11H2,1-2H3,(H,23,24)(H2,20,21,22,26)
InChIKey CQXXKDFLWAXKMM-UHFFFAOYSA-N
Properties
Density 1.307g/cm3 (Cal.)
Refractive index 1.649 (Cal.)
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