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3,5-Dichloro-2-{[(4-Isopropylbenzoyl)Carbamothioyl]Amino}Benzoic Acid
[CAS# 535976-81-9]

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CAS#: 535976-81-9
Product: 3,5-Dichloro-2-{[(4-Isopropylbenzoyl)Carbamothioyl]Amino}Benzoic Acid
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Identification
Name 3,5-Dichloro-2-{[(4-Isopropylbenzoyl)Carbamothioyl]Amino}Benzoic Acid
Molecular Structure CAS#: 535976-81-9, 3,5-Dichloro-2-{[(4-Isopropylbenzoyl)Carbamothioyl]Amino}Benzoic Acid
Molecular Formula C18H16Cl2N2O3S
Molecular Weight 411.30
CAS Registry Number 535976-81-9
SMILES Clc2cc(Cl)cc(c2NC(=S)NC(=O)c1ccc(cc1)C(C)C)C(=O)O
InChI 1S/C18H16Cl2N2O3S/c1-9(2)10-3-5-11(6-4-10)16(23)22-18(26)21-15-13(17(24)25)7-12(19)8-14(15)20/h3-9H,1-2H3,(H,24,25)(H2,21,22,23,26)
InChIKey DHFUQUAHAIIDJD-UHFFFAOYSA-N
Properties
Density 1.443g/cm3 (Cal.)
Refractive index 1.676 (Cal.)
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