2-[1-[(3,4-dimethoxyphenyl)methyl]-4-ethanoyl-1-(6-imidazol-1-ylpyrimidin-4-yl)piperazin-1-ium-2-yl]ethanamide

Systemtic Name: 2-[1-[(3,4-dimethoxyphenyl)methyl]-4-ethanoyl-1-(6-imidazol-1-ylpyrimidin-4-yl)piperazin-1-ium-2-yl]ethanamide Openeye Name: 2-[4-acetyl-1-[(3,4-dimethoxyphenyl)methyl]-1-(6-imidazol-1-ylpyrimidin-4-yl)piperazin-1-ium-2-yl]acetamide CAS Name: 2-[4-acetyl-1-[(3,4-dimethoxyphenyl)methyl]-1-[6-(1-imidazolyl)-4-pyrimidinyl]-2-piperazin-1-iumyl]acetamide IUPAC Name: 2-[4-acetyl-1-[(3,4-dimethoxyphenyl)methyl]-1-(6-imidazol-1-ylpyrimidin-4-yl)piperazin-1-ium-2-yl]acetamide Traditional Name: 2-[4-acetyl-1-(6-imidazol-1-ylpyrimidin-4-yl)-1-veratryl-piperazin-1-ium-2-yl]acetamide Formula: C24H30N7O4+ MolecularWeight: 480.5395

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N1CC[N+](C(C1)CC(=O)N)(CC2=CC(=C(C=C2)OC)OC)C3=NC=NC(=C3)N4C=CN=C4

Isomeric SMILES

CC(=O)N1CC[N+](C(C1)CC(=O)N)(CC2=CC(=C(C=C2)OC)OC)C3=NC=NC(=C3)N4C=CN=C4

InChI

InChI=1S/C24H29N7O4/c1-17(32)29-8-9-31(19(13-29)11-22(25)33,14-18-4-5-20(34-2)21(10-18)35-3)24-12-23(27-15-28-24)30-7-6-26-16-30/h4-7,10,12,15-16,19H,8-9,11,13-14H2,1-3H3,(H-,25,33)/p+1