N-(2,3-dimethylphenyl)-N-[4-[(4-ethanoylpiperazin-1-ium-1-yl)methyl]-1,3-thiazol-2-yl]ethanamide

Systemtic Name: N-(2,3-dimethylphenyl)-N-[4-[(4-ethanoylpiperazin-1-ium-1-yl)methyl]-1,3-thiazol-2-yl]ethanamide Openeye Name: N-[4-[(4-acetylpiperazin-1-ium-1-yl)methyl]thiazol-2-yl]-N-(2,3-dimethylphenyl)acetamide CAS Name: N-[4-[(4-acetyl-1-piperazin-1-iumyl)methyl]-2-thiazolyl]-N-(2,3-dimethylphenyl)acetamide IUPAC Name: N-[4-[(4-acetylpiperazin-1-ium-1-yl)methyl]-1,3-thiazol-2-yl]-N-(2,3-dimethylphenyl)acetamide Traditional Name: N-[4-[(4-acetylpiperazin-1-ium-1-yl)methyl]thiazol-2-yl]-N-(2,3-dimethylphenyl)acetamide Formula: C20H27N4O2S+ MolecularWeight: 387.51898

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)N(C2=NC(=CS2)C[NH+]3CCN(CC3)C(=O)C)C(=O)C)C

Isomeric SMILES

CC1=C(C(=CC=C1)N(C2=NC(=CS2)C[NH+]3CCN(CC3)C(=O)C)C(=O)C)C

InChI

InChI=1S/C20H26N4O2S/c1-14-6-5-7-19(15(14)2)24(17(4)26)20-21-18(13-27-20)12-22-8-10-23(11-9-22)16(3)25/h5-7,13H,8-12H2,1-4H3/p+1