4-chloranyl-5-iodanyl-1-benzothiophene-2-carboximidamide trihydrate hydrochloride

Systemtic Name: 4-chloranyl-5-iodanyl-1-benzothiophene-2-carboximidamide trihydrate hydrochloride Openeye Name: 4-chloro-5-iodo-benzothiophene-2-carboxamidine trihydrate hydrochloride CAS Name: 4-chloro-5-iodo-1-benzothiophene-2-carboximidamide trihydrate hydrochloride IUPAC Name: 4-chloro-5-iodo-1-benzothiophene-2-carboximidamide trihydrate hydrochloride Traditional Name: 4-chloro-5-iodo-benzothiophene-2-carboxamidine trihydrate hydrochloride Formula: C9H13Cl2IN2O3S MolecularWeight: 427.08659

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C2=C1SC(=C2)C(=N)N)Cl)I.O.O.O.Cl

Isomeric SMILES

C1=CC(=C(C2=C1SC(=C2)C(=N)N)Cl)I.O.O.O.Cl

InChI

InChI=1S/C9H6ClIN2S.ClH.3H2O/c10-8-4-3-7(9(12)13)14-6(4)2-1-5(8)11;;;;/h1-3H,(H3,12,13);1H;3*1H2