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

Systemtic Name: (2R)-2-[4-(6-methyl-2-propan-2-yl-pyrimidin-4-yl)piperazin-1-ium-1-yl]-N-(4-morpholin-4-ylphenyl)propanamide Openeye Name: (2R)-2-[4-(2-isopropyl-6-methyl-pyrimidin-4-yl)piperazin-1-ium-1-yl]-N-(4-morpholinophenyl)propanamide CAS Name: (2R)-2-[4-(6-methyl-2-propan-2-yl-4-pyrimidinyl)-1-piperazin-1-iumyl]-N-[4-(4-morpholinyl)phenyl]propanamide IUPAC Name: (2R)-2-[4-(6-methyl-2-propan-2-ylpyrimidin-4-yl)piperazin-1-ium-1-yl]-N-(4-morpholin-4-ylphenyl)propanamide Traditional Name: (2R)-2-[4-(2-isopropyl-6-methyl-pyrimidin-4-yl)piperazin-1-ium-1-yl]-N-(4-morpholinophenyl)propionamide Formula: C25H37N6O2+ MolecularWeight: 453.60028

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=N1)C(C)C)N2CC[NH+](CC2)C(C)C(=O)NC3=CC=C(C=C3)N4CCOCC4

Isomeric SMILES

CC1=CC(=NC(=N1)C(C)C)N2CC[NH+](CC2)[C@H](C)C(=O)NC3=CC=C(C=C3)N4CCOCC4

InChI

InChI=1S/C25H36N6O2/c1-18(2)24-26-19(3)17-23(28-24)31-11-9-29(10-12-31)20(4)25(32)27-21-5-7-22(8-6-21)30-13-15-33-16-14-30/h5-8,17-18,20H,9-16H2,1-4H3,(H,27,32)/p+1/t20-/m1/s1