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

Systemtic Name: 2-[1-(6-chloranyl-2-imidazol-1-yl-pyrimidin-4-yl)-1-[(4-chlorophenyl)methyl]piperazin-1-ium-2-yl]ethanamide Openeye Name: 2-[1-(6-chloro-2-imidazol-1-yl-pyrimidin-4-yl)-1-[(4-chlorophenyl)methyl]piperazin-1-ium-2-yl]acetamide CAS Name: 2-[1-[6-chloro-2-(1-imidazolyl)-4-pyrimidinyl]-1-[(4-chlorophenyl)methyl]-2-piperazin-1-iumyl]acetamide IUPAC Name: 2-[1-(6-chloro-2-imidazol-1-ylpyrimidin-4-yl)-1-[(4-chlorophenyl)methyl]piperazin-1-ium-2-yl]acetamide Traditional Name: 2-[1-(4-chlorobenzyl)-1-(6-chloro-2-imidazol-1-yl-pyrimidin-4-yl)piperazin-1-ium-2-yl]acetamide Formula: C20H22Cl2N7O+ MolecularWeight: 447.34098

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Descriptors Computed from Structure

Canonical SMILES:

C1C[N+](C(CN1)CC(=O)N)(CC2=CC=C(C=C2)Cl)C3=CC(=NC(=N3)N4C=CN=C4)Cl

Isomeric SMILES

C1C[N+](C(CN1)CC(=O)N)(CC2=CC=C(C=C2)Cl)C3=CC(=NC(=N3)N4C=CN=C4)Cl

InChI

InChI=1S/C20H21Cl2N7O/c21-15-3-1-14(2-4-15)12-29(8-6-24-11-16(29)9-18(23)30)19-10-17(22)26-20(27-19)28-7-5-25-13-28/h1-5,7,10,13,16,24H,6,8-9,11-12H2,(H-,23,30)/p+1