N-(2-fluorophenyl)-4-[[2-(4-methoxyphenyl)-1,3-thiazol-4-yl]methyl]piperazin-4-ium-1-carboxamide

Systemtic Name: N-(2-fluorophenyl)-4-[[2-(4-methoxyphenyl)-1,3-thiazol-4-yl]methyl]piperazin-4-ium-1-carboxamide Openeye Name: N-(2-fluorophenyl)-4-[[2-(4-methoxyphenyl)thiazol-4-yl]methyl]piperazin-4-ium-1-carboxamide CAS Name: N-(2-fluorophenyl)-4-[[2-(4-methoxyphenyl)-4-thiazolyl]methyl]-1-piperazin-4-iumcarboxamide IUPAC Name: N-(2-fluorophenyl)-4-[[2-(4-methoxyphenyl)-1,3-thiazol-4-yl]methyl]piperazin-4-ium-1-carboxamide Traditional Name: N-(2-fluorophenyl)-4-[[2-(4-methoxyphenyl)thiazol-4-yl]methyl]piperazin-4-ium-1-carboxamide Formula: C22H24FN4O2S+ MolecularWeight: 427.514963

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2=NC(=CS2)C[NH+]3CCN(CC3)C(=O)NC4=CC=CC=C4F

Isomeric SMILES

COC1=CC=C(C=C1)C2=NC(=CS2)C[NH+]3CCN(CC3)C(=O)NC4=CC=CC=C4F

InChI

InChI=1S/C22H23FN4O2S/c1-29-18-8-6-16(7-9-18)21-24-17(15-30-21)14-26-10-12-27(13-11-26)22(28)25-20-5-3-2-4-19(20)23/h2-9,15H,10-14H2,1H3,(H,25,28)/p+1