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

Systemtic Name: 2-[1-(4-methoxyphenyl)imidazol-2-yl]sulfanyl-1-[4-(pyridin-4-ylmethyl)piperazin-4-ium-1-yl]ethanone Openeye Name: 2-[1-(4-methoxyphenyl)imidazol-2-yl]sulfanyl-1-[4-(4-pyridylmethyl)piperazin-4-ium-1-yl]ethanone CAS Name: 2-[[1-(4-methoxyphenyl)-2-imidazolyl]thio]-1-[4-(pyridin-4-ylmethyl)-1-piperazin-4-iumyl]ethanone IUPAC Name: 2-[1-(4-methoxyphenyl)imidazol-2-yl]sulfanyl-1-[4-(pyridin-4-ylmethyl)piperazin-4-ium-1-yl]ethanone Traditional Name: 2-[[1-(4-methoxyphenyl)imidazol-2-yl]thio]-1-[4-(4-pyridylmethyl)piperazin-4-ium-1-yl]ethanone Formula: C22H26N5O2S+ MolecularWeight: 424.53914

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)N2C=CN=C2SCC(=O)N3CC[NH+](CC3)CC4=CC=NC=C4

Isomeric SMILES

COC1=CC=C(C=C1)N2C=CN=C2SCC(=O)N3CC[NH+](CC3)CC4=CC=NC=C4

InChI

InChI=1S/C22H25N5O2S/c1-29-20-4-2-19(3-5-20)27-11-10-24-22(27)30-17-21(28)26-14-12-25(13-15-26)16-18-6-8-23-9-7-18/h2-11H,12-17H2,1H3/p+1