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4-[2,2-bis(bromanyl)ethenyl]-1-benzothiophene-2-carboximidamide trihydrate hydrochloride

4-[2,2-bis(bromanyl)ethenyl]-1-benzothiophene-2-carboximidamide trihydrate hydrochloride

Systemtic Name:4-[2,2-bis(bromanyl)ethenyl]-1-benzothiophene-2-carboximidamide trihydrate hydrochloride
Openeye Name:4-(2,2-dibromovinyl)benzothiophene-2-carboxamidine trihydrate hydrochloride
CAS Name:4-(2,2-dibromoethenyl)-1-benzothiophene-2-carboximidamide trihydrate hydrochloride
IUPAC Name:4-(2,2-dibromoethenyl)-1-benzothiophene-2-carboximidamide trihydrate hydrochloride
Traditional Name:4-(2,2-dibromovinyl)benzothiophene-2-carboxamidine trihydrate hydrochloride
Formula: C11H15Br2ClN2O3S
MolecularWeight: 450.5744
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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C2C=C(SC2=C1)C(=N)N)C=C(Br)Br.O.O.O.Cl


Isomeric SMILES

C1=CC(=C2C=C(SC2=C1)C(=N)N)C=C(Br)Br.O.O.O.Cl


InChI

InChI=1S/C11H8Br2N2S.ClH.3H2O/c12-10(13)4-6-2-1-3-8-7(6)5-9(16-8)11(14)15;;;;/h1-5H,(H3,14,15);1H;3*1H2


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