2-[1-(cyclopropylmethyl)-1-(6-imidazol-1-ylpyrimidin-4-yl)-4-methyl-piperazin-1-ium-2-yl]ethanamide

Systemtic Name: 2-[1-(cyclopropylmethyl)-1-(6-imidazol-1-ylpyrimidin-4-yl)-4-methyl-piperazin-1-ium-2-yl]ethanamide Openeye Name: 2-[1-(cyclopropylmethyl)-1-(6-imidazol-1-ylpyrimidin-4-yl)-4-methyl-piperazin-1-ium-2-yl]acetamide CAS Name: 2-[1-(cyclopropylmethyl)-1-[6-(1-imidazolyl)-4-pyrimidinyl]-4-methyl-2-piperazin-1-iumyl]acetamide IUPAC Name: 2-[1-(cyclopropylmethyl)-1-(6-imidazol-1-ylpyrimidin-4-yl)-4-methylpiperazin-1-ium-2-yl]acetamide Traditional Name: 2-[1-(cyclopropylmethyl)-1-(6-imidazol-1-ylpyrimidin-4-yl)-4-methyl-piperazin-1-ium-2-yl]acetamide Formula: C18H26N7O+ MolecularWeight: 356.44534

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Descriptors Computed from Structure

Canonical SMILES:

CN1CC[N+](C(C1)CC(=O)N)(CC2CC2)C3=NC=NC(=C3)N4C=CN=C4

Isomeric SMILES

CN1CC[N+](C(C1)CC(=O)N)(CC2CC2)C3=NC=NC(=C3)N4C=CN=C4

InChI

InChI=1S/C18H25N7O/c1-23-6-7-25(11-14-2-3-14,15(10-23)8-16(19)26)18-9-17(21-12-22-18)24-5-4-20-13-24/h4-5,9,12-15H,2-3,6-8,10-11H2,1H3,(H-,19,26)/p+1