1-(5-methylthiophen-2-yl)-2-[3-[2-(thiophen-3-ylmethyl)pyrazol-3-yl]pyridin-1-ium-1-yl]ethanone

Systemtic Name: 1-(5-methylthiophen-2-yl)-2-[3-[2-(thiophen-3-ylmethyl)pyrazol-3-yl]pyridin-1-ium-1-yl]ethanone Openeye Name: 1-(5-methyl-2-thienyl)-2-[3-[2-(3-thienylmethyl)pyrazol-3-yl]pyridin-1-ium-1-yl]ethanone CAS Name: 1-(5-methyl-2-thiophenyl)-2-[3-[2-(3-thiophenylmethyl)-3-pyrazolyl]-1-pyridin-1-iumyl]ethanone IUPAC Name: 1-(5-methylthiophen-2-yl)-2-[3-[2-(thiophen-3-ylmethyl)pyrazol-3-yl]pyridin-1-ium-1-yl]ethanone Traditional Name: 1-(5-methyl-2-thienyl)-2-[3-[2-(3-thenyl)pyrazol-3-yl]pyridin-1-ium-1-yl]ethanone Formula: C20H18N3OS2+ MolecularWeight: 380.50642

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(S1)C(=O)C[N+]2=CC=CC(=C2)C3=CC=NN3CC4=CSC=C4

Isomeric SMILES

CC1=CC=C(S1)C(=O)C[N+]2=CC=CC(=C2)C3=CC=NN3CC4=CSC=C4

InChI

InChI=1S/C20H18N3OS2/c1-15-4-5-20(26-15)19(24)13-22-9-2-3-17(12-22)18-6-8-21-23(18)11-16-7-10-25-14-16/h2-10,12,14H,11,13H2,1H3/q+1