1-[2,4-dimethyl-5-[5-methyl-2-(4-methylpiperazin-4-ium-1-yl)-1,3-thiazol-4-yl]-1H-pyrrol-3-yl]ethanone

Systemtic Name: 1-[2,4-dimethyl-5-[5-methyl-2-(4-methylpiperazin-4-ium-1-yl)-1,3-thiazol-4-yl]-1H-pyrrol-3-yl]ethanone Openeye Name: 1-[2,4-dimethyl-5-[5-methyl-2-(4-methylpiperazin-4-ium-1-yl)thiazol-4-yl]-1H-pyrrol-3-yl]ethanone CAS Name: 1-[2,4-dimethyl-5-[5-methyl-2-(4-methyl-1-piperazin-4-iumyl)-4-thiazolyl]-1H-pyrrol-3-yl]ethanone IUPAC Name: 1-[2,4-dimethyl-5-[5-methyl-2-(4-methylpiperazin-4-ium-1-yl)-1,3-thiazol-4-yl]-1H-pyrrol-3-yl]ethanone Traditional Name: 1-[2,4-dimethyl-5-[5-methyl-2-(4-methylpiperazin-4-ium-1-yl)thiazol-4-yl]-1H-pyrrol-3-yl]ethanone Formula: C17H25N4OS+ MolecularWeight: 333.4716

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(NC(=C1C(=O)C)C)C2=C(SC(=N2)N3CC[NH+](CC3)C)C

Isomeric SMILES

CC1=C(NC(=C1C(=O)C)C)C2=C(SC(=N2)N3CC[NH+](CC3)C)C

InChI

InChI=1S/C17H24N4OS/c1-10-14(12(3)22)11(2)18-15(10)16-13(4)23-17(19-16)21-8-6-20(5)7-9-21/h18H,6-9H2,1-5H3/p+1