1-[2-[[4-(2-methoxyphenyl)piperazin-1-ium-1-yl]methyl]-4-methyl-1,3-thiazol-5-yl]ethanone

Systemtic Name: 1-[2-[[4-(2-methoxyphenyl)piperazin-1-ium-1-yl]methyl]-4-methyl-1,3-thiazol-5-yl]ethanone Openeye Name: 1-[2-[[4-(2-methoxyphenyl)piperazin-1-ium-1-yl]methyl]-4-methyl-thiazol-5-yl]ethanone CAS Name: 1-[2-[[4-(2-methoxyphenyl)-1-piperazin-1-iumyl]methyl]-4-methyl-5-thiazolyl]ethanone IUPAC Name: 1-[2-[[4-(2-methoxyphenyl)piperazin-1-ium-1-yl]methyl]-4-methyl-1,3-thiazol-5-yl]ethanone Traditional Name: 1-[2-[[4-(2-methoxyphenyl)piperazin-1-ium-1-yl]methyl]-4-methyl-thiazol-5-yl]ethanone Formula: C18H24N3O2S+ MolecularWeight: 346.46706

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=N1)C[NH+]2CCN(CC2)C3=CC=CC=C3OC)C(=O)C

Isomeric SMILES

CC1=C(SC(=N1)C[NH+]2CCN(CC2)C3=CC=CC=C3OC)C(=O)C

InChI

InChI=1S/C18H23N3O2S/c1-13-18(14(2)22)24-17(19-13)12-20-8-10-21(11-9-20)15-6-4-5-7-16(15)23-3/h4-7H,8-12H2,1-3H3/p+1