[2,3,4,5,6-pentakis(chloranyl)phenyl]methyl carbamimidothioate hydrochloride

Systemtic Name: [2,3,4,5,6-pentakis(chloranyl)phenyl]methyl carbamimidothioate hydrochloride Openeye Name: 2-[(2,3,4,5,6-pentachlorophenyl)methyl]isothiourea hydrochloride CAS Name: carbamimidothioic acid (2,3,4,5,6-pentachlorophenyl)methyl ester hydrochloride IUPAC Name: (2,3,4,5,6-pentachlorophenyl)methyl carbamimidothioate hydrochloride Traditional Name: 2-(2,3,4,5,6-pentachlorobenzyl)isothiourea hydrochloride Formula: C8H6Cl6N2S MolecularWeight: 374.92964

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Descriptors Computed from Structure

Canonical SMILES:

C(C1=C(C(=C(C(=C1Cl)Cl)Cl)Cl)Cl)SC(=N)N.Cl

Isomeric SMILES

C(C1=C(C(=C(C(=C1Cl)Cl)Cl)Cl)Cl)SC(=N)N.Cl

InChI

InChI=1S/C8H5Cl5N2S.ClH/c9-3-2(1-16-8(14)15)4(10)6(12)7(13)5(3)11;/h1H2,(H3,14,15);1H