7-[2-(1,3-benzodioxol-5-yl)ethynyl]-1-benzothiophene-2-carboximidamide hydrochloride

Systemtic Name: 7-[2-(1,3-benzodioxol-5-yl)ethynyl]-1-benzothiophene-2-carboximidamide hydrochloride Openeye Name: 7-[2-(1,3-benzodioxol-5-yl)ethynyl]benzothiophene-2-carboxamidine hydrochloride CAS Name: 7-[2-(1,3-benzodioxol-5-yl)ethynyl]-1-benzothiophene-2-carboximidamide hydrochloride IUPAC Name: 7-[2-(1,3-benzodioxol-5-yl)ethynyl]-1-benzothiophene-2-carboximidamide hydrochloride Traditional Name: 7-[2-(1,3-benzodioxol-5-yl)ethynyl]benzothiophene-2-carboxamidine hydrochloride Formula: C18H13ClN2O2S MolecularWeight: 356.82602

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)C#CC3=C4C(=CC=C3)C=C(S4)C(=N)N.Cl

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)C#CC3=C4C(=CC=C3)C=C(S4)C(=N)N.Cl

InChI

InChI=1S/C18H12N2O2S.ClH/c19-18(20)16-9-13-3-1-2-12(17(13)23-16)6-4-11-5-7-14-15(8-11)22-10-21-14;/h1-3,5,7-9H,10H2,(H3,19,20);1H