N-(2-methylphenyl)-2-(4-thiophen-2-ylpyrimidin-1-ium-1-yl)ethanamide

Systemtic Name: N-(2-methylphenyl)-2-(4-thiophen-2-ylpyrimidin-1-ium-1-yl)ethanamide Openeye Name: N-(o-tolyl)-2-[4-(2-thienyl)pyrimidin-1-ium-1-yl]acetamide CAS Name: N-(2-methylphenyl)-2-(4-thiophen-2-yl-1-pyrimidin-1-iumyl)acetamide IUPAC Name: N-(2-methylphenyl)-2-(4-thiophen-2-ylpyrimidin-1-ium-1-yl)acetamide Traditional Name: N-(o-tolyl)-2-[4-(2-thienyl)pyrimidin-1-ium-1-yl]acetamide Formula: C17H16N3OS+ MolecularWeight: 310.39344

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1NC(=O)C[N+]2=CN=C(C=C2)C3=CC=CS3

Isomeric SMILES

CC1=CC=CC=C1NC(=O)C[N+]2=CN=C(C=C2)C3=CC=CS3

InChI

InChI=1S/C17H15N3OS/c1-13-5-2-3-6-14(13)19-17(21)11-20-9-8-15(18-12-20)16-7-4-10-22-16/h2-10,12H,11H2,1H3/p+1