2-(4-ethanoylpiperazin-1-ium-1-yl)-N-(4-methyl-1,3-benzothiazol-2-yl)-N-(phenylmethyl)ethanamide

Systemtic Name: 2-(4-ethanoylpiperazin-1-ium-1-yl)-N-(4-methyl-1,3-benzothiazol-2-yl)-N-(phenylmethyl)ethanamide Openeye Name: 2-(4-acetylpiperazin-1-ium-1-yl)-N-benzyl-N-(4-methyl-1,3-benzothiazol-2-yl)acetamide CAS Name: 2-(4-acetyl-1-piperazin-1-iumyl)-N-(4-methyl-1,3-benzothiazol-2-yl)-N-(phenylmethyl)acetamide IUPAC Name: 2-(4-acetylpiperazin-1-ium-1-yl)-N-benzyl-N-(4-methyl-1,3-benzothiazol-2-yl)acetamide Traditional Name: 2-(4-acetylpiperazin-1-ium-1-yl)-N-benzyl-N-(4-methyl-1,3-benzothiazol-2-yl)acetamide Formula: C23H27N4O2S+ MolecularWeight: 423.55108

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C(=CC=C1)SC(=N2)N(CC3=CC=CC=C3)C(=O)C[NH+]4CCN(CC4)C(=O)C

Isomeric SMILES

CC1=C2C(=CC=C1)SC(=N2)N(CC3=CC=CC=C3)C(=O)C[NH+]4CCN(CC4)C(=O)C

InChI

InChI=1S/C23H26N4O2S/c1-17-7-6-10-20-22(17)24-23(30-20)27(15-19-8-4-3-5-9-19)21(29)16-25-11-13-26(14-12-25)18(2)28/h3-10H,11-16H2,1-2H3/p+1