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The molecular formula is C7H6Cl2N2S.
The molecular weight is 221.11 g/mol.
The IUPAC name is (3,5-dichlorophenyl)thiourea.
The InChI of N-(3,5-Dichlorophenyl)thiourea is InChI=1S/C7H6Cl2N2S/c8-4-1-5(9)3-6(2-4)11-7(10)12/h1-3H,(H3,10,11,12).
The InChIKey is BNJARXOEVLYKDN-UHFFFAOYSA-N.
The Canonical SMILES is C1=C(C=C(C=C1Cl)Cl)NC(=S)N.
The CAS number is 107707-33-5.
The ChEMBL ID is CHEMBL1461007.
The XLogP3-AA value is 2.4.
Yes, N-(3,5-Dichlorophenyl)thiourea is canonicalized.
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