(2R)-N-(methylcarbamoyl)-2-[4-(6-methyl-2-propan-2-yl-pyrimidin-4-yl)piperazin-1-ium-1-yl]-2-phenyl-ethanamide

Systemtic Name: (2R)-N-(methylcarbamoyl)-2-[4-(6-methyl-2-propan-2-yl-pyrimidin-4-yl)piperazin-1-ium-1-yl]-2-phenyl-ethanamide Openeye Name: (2R)-2-[4-(2-isopropyl-6-methyl-pyrimidin-4-yl)piperazin-1-ium-1-yl]-N-(methylcarbamoyl)-2-phenyl-acetamide CAS Name: (2R)-N-(methylcarbamoyl)-2-[4-(6-methyl-2-propan-2-yl-4-pyrimidinyl)-1-piperazin-1-iumyl]-2-phenylacetamide IUPAC Name: (2R)-N-(methylcarbamoyl)-2-[4-(6-methyl-2-propan-2-ylpyrimidin-4-yl)piperazin-1-ium-1-yl]-2-phenylacetamide Traditional Name: (2R)-2-[4-(2-isopropyl-6-methyl-pyrimidin-4-yl)piperazin-1-ium-1-yl]-N-(methylcarbamoyl)-2-phenyl-acetamide Formula: C22H31N6O2+ MolecularWeight: 411.52054

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=N1)C(C)C)N2CC[NH+](CC2)C(C3=CC=CC=C3)C(=O)NC(=O)NC

Isomeric SMILES

CC1=CC(=NC(=N1)C(C)C)N2CC[NH+](CC2)[C@H](C3=CC=CC=C3)C(=O)NC(=O)NC

InChI

InChI=1S/C22H30N6O2/c1-15(2)20-24-16(3)14-18(25-20)27-10-12-28(13-11-27)19(17-8-6-5-7-9-17)21(29)26-22(30)23-4/h5-9,14-15,19H,10-13H2,1-4H3,(H2,23,26,29,30)/p+1/t19-/m1/s1