(6-chloranyl-4H-1,3-benzodioxin-8-yl)methyl carbamimidothioate hydrochloride

Systemtic Name: (6-chloranyl-4H-1,3-benzodioxin-8-yl)methyl carbamimidothioate hydrochloride Openeye Name: 2-[(6-chloro-4H-1,3-benzodioxin-8-yl)methyl]isothiourea hydrochloride CAS Name: carbamimidothioic acid (6-chloro-4H-1,3-benzodioxin-8-yl)methyl ester hydrochloride IUPAC Name: (6-chloro-4H-1,3-benzodioxin-8-yl)methyl carbamimidothioate hydrochloride Traditional Name: 2-[(6-chloro-4H-1,3-benzodioxin-8-yl)methyl]isothiourea hydrochloride Formula: C10H12Cl2N2O2S MolecularWeight: 295.18548

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Descriptors Computed from Structure

Canonical SMILES:

C1C2=CC(=CC(=C2OCO1)CSC(=N)N)Cl.Cl

Isomeric SMILES

C1C2=CC(=CC(=C2OCO1)CSC(=N)N)Cl.Cl

InChI

InChI=1S/C10H11ClN2O2S.ClH/c11-8-1-6-3-14-5-15-9(6)7(2-8)4-16-10(12)13;/h1-2H,3-5H2,(H3,12,13);1H