2-[1-(4-methoxyphenyl)imidazol-2-yl]sulfanyl-1-(4-pyridin-1-ium-4-ylpiperazin-1-yl)ethanone

Systemtic Name: 2-[1-(4-methoxyphenyl)imidazol-2-yl]sulfanyl-1-(4-pyridin-1-ium-4-ylpiperazin-1-yl)ethanone Openeye Name: 2-[1-(4-methoxyphenyl)imidazol-2-yl]sulfanyl-1-(4-pyridin-1-ium-4-ylpiperazin-1-yl)ethanone CAS Name: 2-[[1-(4-methoxyphenyl)-2-imidazolyl]thio]-1-[4-(4-pyridin-1-iumyl)-1-piperazinyl]ethanone IUPAC Name: 2-[1-(4-methoxyphenyl)imidazol-2-yl]sulfanyl-1-(4-pyridin-1-ium-4-ylpiperazin-1-yl)ethanone Traditional Name: 2-[[1-(4-methoxyphenyl)imidazol-2-yl]thio]-1-(4-pyridin-1-ium-4-ylpiperazino)ethanone Formula: C21H24N5O2S+ MolecularWeight: 410.51256

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)N2C=CN=C2SCC(=O)N3CCN(CC3)C4=CC=[NH+]C=C4

Isomeric SMILES

COC1=CC=C(C=C1)N2C=CN=C2SCC(=O)N3CCN(CC3)C4=CC=[NH+]C=C4

InChI

InChI=1S/C21H23N5O2S/c1-28-19-4-2-18(3-5-19)26-11-10-23-21(26)29-16-20(27)25-14-12-24(13-15-25)17-6-8-22-9-7-17/h2-11H,12-16H2,1H3/p+1