2-[1-(2-imidazol-1-yl-6-methyl-pyrimidin-4-yl)-4-(2-methoxyethanoyl)-1-[(4-methoxyphenyl)methyl]piperazin-1-ium-2-yl]ethanamide

Systemtic Name: 2-[1-(2-imidazol-1-yl-6-methyl-pyrimidin-4-yl)-4-(2-methoxyethanoyl)-1-[(4-methoxyphenyl)methyl]piperazin-1-ium-2-yl]ethanamide Openeye Name: 2-[1-(2-imidazol-1-yl-6-methyl-pyrimidin-4-yl)-4-(2-methoxyacetyl)-1-[(4-methoxyphenyl)methyl]piperazin-1-ium-2-yl]acetamide CAS Name: 2-[1-[2-(1-imidazolyl)-6-methyl-4-pyrimidinyl]-4-(2-methoxy-1-oxoethyl)-1-[(4-methoxyphenyl)methyl]-2-piperazin-1-iumyl]acetamide IUPAC Name: 2-[1-(2-imidazol-1-yl-6-methylpyrimidin-4-yl)-4-(2-methoxyacetyl)-1-[(4-methoxyphenyl)methyl]piperazin-1-ium-2-yl]acetamide Traditional Name: 2-[1-(2-imidazol-1-yl-6-methyl-pyrimidin-4-yl)-4-(2-methoxyacetyl)-1-p-anisyl-piperazin-1-ium-2-yl]acetamide Formula: C25H32N7O4+ MolecularWeight: 494.56608

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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)COC)CC4=CC=C(C=C4)OC

Isomeric SMILES

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

InChI

InChI=1S/C25H31N7O4/c1-18-12-23(29-25(28-18)31-9-8-27-17-31)32(15-19-4-6-21(36-3)7-5-19)11-10-30(24(34)16-35-2)14-20(32)13-22(26)33/h4-9,12,17,20H,10-11,13-16H2,1-3H3,(H-,26,33)/p+1