(2R)-N-aminocarbonyl-2-phenyl-2-(4-pyrimidin-2-ylpiperazin-1-ium-1-yl)ethanamide

Systemtic Name: (2R)-N-aminocarbonyl-2-phenyl-2-(4-pyrimidin-2-ylpiperazin-1-ium-1-yl)ethanamide Openeye Name: (2R)-N-carbamoyl-2-phenyl-2-(4-pyrimidin-2-ylpiperazin-1-ium-1-yl)acetamide CAS Name: (2R)-N-carbamoyl-2-phenyl-2-[4-(2-pyrimidinyl)-1-piperazin-1-iumyl]acetamide IUPAC Name: (2R)-N-carbamoyl-2-phenyl-2-(4-pyrimidin-2-ylpiperazin-1-ium-1-yl)acetamide Traditional Name: (2R)-N-carbamoyl-2-phenyl-2-[4-(2-pyrimidyl)piperazin-1-ium-1-yl]acetamide Formula: C17H21N6O2+ MolecularWeight: 341.38764

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1C(C2=CC=CC=C2)C(=O)NC(=O)N)C3=NC=CC=N3

Isomeric SMILES

C1CN(CC[NH+]1[C@H](C2=CC=CC=C2)C(=O)NC(=O)N)C3=NC=CC=N3

InChI

InChI=1S/C17H20N6O2/c18-16(25)21-15(24)14(13-5-2-1-3-6-13)22-9-11-23(12-10-22)17-19-7-4-8-20-17/h1-8,14H,9-12H2,(H3,18,21,24,25)/p+1/t14-/m1/s1