2-[1-[(3-chloranyl-4-methoxy-phenyl)methyl]-4-ethanoyl-1-(2-imidazol-1-yl-6-methyl-pyrimidin-4-yl)piperazin-1-ium-2-yl]ethanamide

Systemtic Name: 2-[1-[(3-chloranyl-4-methoxy-phenyl)methyl]-4-ethanoyl-1-(2-imidazol-1-yl-6-methyl-pyrimidin-4-yl)piperazin-1-ium-2-yl]ethanamide Openeye Name: 2-[4-acetyl-1-[(3-chloro-4-methoxy-phenyl)methyl]-1-(2-imidazol-1-yl-6-methyl-pyrimidin-4-yl)piperazin-1-ium-2-yl]acetamide CAS Name: 2-[4-acetyl-1-[(3-chloro-4-methoxyphenyl)methyl]-1-[2-(1-imidazolyl)-6-methyl-4-pyrimidinyl]-2-piperazin-1-iumyl]acetamide IUPAC Name: 2-[4-acetyl-1-[(3-chloro-4-methoxyphenyl)methyl]-1-(2-imidazol-1-yl-6-methylpyrimidin-4-yl)piperazin-1-ium-2-yl]acetamide Traditional Name: 2-[4-acetyl-1-(3-chloro-4-methoxy-benzyl)-1-(2-imidazol-1-yl-6-methyl-pyrimidin-4-yl)piperazin-1-ium-2-yl]acetamide Formula: C24H29ClN7O3+ MolecularWeight: 498.98516

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=N1)N2C=CN=C2)[N+]3(CCN(CC3CC(=O)N)C(=O)C)CC4=CC(=C(C=C4)OC)Cl

Isomeric SMILES

CC1=CC(=NC(=N1)N2C=CN=C2)[N+]3(CCN(CC3CC(=O)N)C(=O)C)CC4=CC(=C(C=C4)OC)Cl

InChI

InChI=1S/C24H28ClN7O3/c1-16-10-23(29-24(28-16)31-7-6-27-15-31)32(14-18-4-5-21(35-3)20(25)11-18)9-8-30(17(2)33)13-19(32)12-22(26)34/h4-7,10-11,15,19H,8-9,12-14H2,1-3H3,(H-,26,34)/p+1