N-[(R)-(1-methylimidazol-2-yl)-phenyl-methyl]-2-(4-pyrazin-2-ylpiperazin-1-ium-1-yl)ethanamide

Systemtic Name: N-[(R)-(1-methylimidazol-2-yl)-phenyl-methyl]-2-(4-pyrazin-2-ylpiperazin-1-ium-1-yl)ethanamide Openeye Name: N-[(R)-(1-methylimidazol-2-yl)-phenyl-methyl]-2-(4-pyrazin-2-ylpiperazin-1-ium-1-yl)acetamide CAS Name: N-[(R)-(1-methyl-2-imidazolyl)-phenylmethyl]-2-[4-(2-pyrazinyl)-1-piperazin-1-iumyl]acetamide IUPAC Name: N-[(R)-(1-methylimidazol-2-yl)-phenylmethyl]-2-(4-pyrazin-2-ylpiperazin-1-ium-1-yl)acetamide Traditional Name: N-[(R)-(1-methylimidazol-2-yl)-phenyl-methyl]-2-(4-pyrazin-2-ylpiperazin-1-ium-1-yl)acetamide Formula: C21H26N7O+ MolecularWeight: 392.47744

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=CN=C1C(C2=CC=CC=C2)NC(=O)C[NH+]3CCN(CC3)C4=NC=CN=C4

Isomeric SMILES

CN1C=CN=C1[C@@H](C2=CC=CC=C2)NC(=O)C[NH+]3CCN(CC3)C4=NC=CN=C4

InChI

InChI=1S/C21H25N7O/c1-26-10-9-24-21(26)20(17-5-3-2-4-6-17)25-19(29)16-27-11-13-28(14-12-27)18-15-22-7-8-23-18/h2-10,15,20H,11-14,16H2,1H3,(H,25,29)/p+1/t20-/m1/s1