3-chloranyl-N-(4,6-dimethylpyridin-1-ium-2-yl)-1-benzothiophene-2-carboxamide

Systemtic Name: 3-chloranyl-N-(4,6-dimethylpyridin-1-ium-2-yl)-1-benzothiophene-2-carboxamide Openeye Name: 3-chloro-N-(4,6-dimethylpyridin-1-ium-2-yl)benzothiophene-2-carboxamide CAS Name: 3-chloro-N-(4,6-dimethyl-2-pyridin-1-iumyl)-1-benzothiophene-2-carboxamide IUPAC Name: 3-chloro-N-(4,6-dimethylpyridin-1-ium-2-yl)-1-benzothiophene-2-carboxamide Traditional Name: 3-chloro-N-(4,6-dimethylpyridin-1-ium-2-yl)benzothiophene-2-carboxamide Formula: C16H14ClN2OS+ MolecularWeight: 317.81316

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=[NH+]C(=C1)NC(=O)C2=C(C3=CC=CC=C3S2)Cl)C

Isomeric SMILES

CC1=CC(=[NH+]C(=C1)NC(=O)C2=C(C3=CC=CC=C3S2)Cl)C

InChI

InChI=1S/C16H13ClN2OS/c1-9-7-10(2)18-13(8-9)19-16(20)15-14(17)11-5-3-4-6-12(11)21-15/h3-8H,1-2H3,(H,18,19,20)/p+1