(2R)-2-[4-(6-methyl-2-propan-2-yl-pyrimidin-4-yl)piperazin-1-ium-1-yl]-N-[(1R)-1-phenylethyl]propanamide

Systemtic Name: (2R)-2-[4-(6-methyl-2-propan-2-yl-pyrimidin-4-yl)piperazin-1-ium-1-yl]-N-[(1R)-1-phenylethyl]propanamide Openeye Name: (2R)-2-[4-(2-isopropyl-6-methyl-pyrimidin-4-yl)piperazin-1-ium-1-yl]-N-[(1R)-1-phenylethyl]propanamide CAS Name: (2R)-2-[4-(6-methyl-2-propan-2-yl-4-pyrimidinyl)-1-piperazin-1-iumyl]-N-[(1R)-1-phenylethyl]propanamide IUPAC Name: (2R)-2-[4-(6-methyl-2-propan-2-ylpyrimidin-4-yl)piperazin-1-ium-1-yl]-N-[(1R)-1-phenylethyl]propanamide Traditional Name: (2R)-2-[4-(2-isopropyl-6-methyl-pyrimidin-4-yl)piperazin-1-ium-1-yl]-N-[(1R)-1-phenylethyl]propionamide Formula: C23H34N5O+ MolecularWeight: 396.54896

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H33N5O/c1-16(2)22-24-17(3)15-21(26-22)28-13-11-27(12-14-28)19(5)23(29)25-18(4)20-9-7-6-8-10-20/h6-10,15-16,18-19H,11-14H2,1-5H3,(H,25,29)/p+1/t18-,19-/m1/s1