3-[4-(6-methyl-2-propan-2-yl-pyrimidin-4-yl)piperazin-1-ium-1-yl]-N-[2-(phenylcarbonyl)phenyl]propanamide

Systemtic Name: 3-[4-(6-methyl-2-propan-2-yl-pyrimidin-4-yl)piperazin-1-ium-1-yl]-N-[2-(phenylcarbonyl)phenyl]propanamide Openeye Name: N-(2-benzoylphenyl)-3-[4-(2-isopropyl-6-methyl-pyrimidin-4-yl)piperazin-1-ium-1-yl]propanamide CAS Name: N-(2-benzoylphenyl)-3-[4-(6-methyl-2-propan-2-yl-4-pyrimidinyl)-1-piperazin-1-iumyl]propanamide IUPAC Name: N-(2-benzoylphenyl)-3-[4-(6-methyl-2-propan-2-ylpyrimidin-4-yl)piperazin-1-ium-1-yl]propanamide Traditional Name: N-(2-benzoylphenyl)-3-[4-(2-isopropyl-6-methyl-pyrimidin-4-yl)piperazin-1-ium-1-yl]propionamide Formula: C28H34N5O2+ MolecularWeight: 472.60186

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=N1)C(C)C)N2CC[NH+](CC2)CCC(=O)NC3=CC=CC=C3C(=O)C4=CC=CC=C4

Isomeric SMILES

CC1=CC(=NC(=N1)C(C)C)N2CC[NH+](CC2)CCC(=O)NC3=CC=CC=C3C(=O)C4=CC=CC=C4

InChI

InChI=1S/C28H33N5O2/c1-20(2)28-29-21(3)19-25(31-28)33-17-15-32(16-18-33)14-13-26(34)30-24-12-8-7-11-23(24)27(35)22-9-5-4-6-10-22/h4-12,19-20H,13-18H2,1-3H3,(H,30,34)/p+1