3-chloranyl-6-methyl-N-(5-methylpyridin-1-ium-2-yl)-1-benzothiophene-2-carboxamide

Systemtic Name: 3-chloranyl-6-methyl-N-(5-methylpyridin-1-ium-2-yl)-1-benzothiophene-2-carboxamide Openeye Name: 3-chloro-6-methyl-N-(5-methylpyridin-1-ium-2-yl)benzothiophene-2-carboxamide CAS Name: 3-chloro-6-methyl-N-(5-methyl-2-pyridin-1-iumyl)-1-benzothiophene-2-carboxamide IUPAC Name: 3-chloro-6-methyl-N-(5-methylpyridin-1-ium-2-yl)-1-benzothiophene-2-carboxamide Traditional Name: 3-chloro-6-methyl-N-(5-methylpyridin-1-ium-2-yl)benzothiophene-2-carboxamide Formula: C16H14ClN2OS+ MolecularWeight: 317.81316

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)C(=C(S2)C(=O)NC3=[NH+]C=C(C=C3)C)Cl

Isomeric SMILES

CC1=CC2=C(C=C1)C(=C(S2)C(=O)NC3=[NH+]C=C(C=C3)C)Cl

InChI

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