2-[1-(6-chloranyl-2-imidazol-1-yl-pyrimidin-4-yl)-4-ethanoyl-1-[1-(3-methoxyphenyl)ethyl]piperazin-1-ium-2-yl]ethanamide

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

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC(=CC=C1)OC)[N+]2(CCN(CC2CC(=O)N)C(=O)C)C3=CC(=NC(=N3)N4C=CN=C4)Cl

Isomeric SMILES

CC(C1=CC(=CC=C1)OC)[N+]2(CCN(CC2CC(=O)N)C(=O)C)C3=CC(=NC(=N3)N4C=CN=C4)Cl

InChI

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