2-[[4-(phenylmethyl)piperazin-1-ium-1-yl]methyl]-N-[(2R)-1-pyridin-3-ylpropan-2-yl]-1,3-oxazole-4-carboxamide

Systemtic Name: 2-[[4-(phenylmethyl)piperazin-1-ium-1-yl]methyl]-N-[(2R)-1-pyridin-3-ylpropan-2-yl]-1,3-oxazole-4-carboxamide Openeye Name: 2-[(4-benzylpiperazin-1-ium-1-yl)methyl]-N-[(1R)-1-methyl-2-(3-pyridyl)ethyl]oxazole-4-carboxamide CAS Name: 2-[[4-(phenylmethyl)-1-piperazin-1-iumyl]methyl]-N-[(2R)-1-(3-pyridinyl)propan-2-yl]-4-oxazolecarboxamide IUPAC Name: 2-[(4-benzylpiperazin-1-ium-1-yl)methyl]-N-[(2R)-1-pyridin-3-ylpropan-2-yl]-1,3-oxazole-4-carboxamide Traditional Name: 2-[(4-benzylpiperazin-1-ium-1-yl)methyl]-N-[(1R)-1-methyl-2-(3-pyridyl)ethyl]oxazole-4-carboxamide Formula: C24H30N5O2+ MolecularWeight: 420.5273

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Descriptors Computed from Structure

Canonical SMILES:

CC(CC1=CN=CC=C1)NC(=O)C2=COC(=N2)C[NH+]3CCN(CC3)CC4=CC=CC=C4

Isomeric SMILES

C[C@H](CC1=CN=CC=C1)NC(=O)C2=COC(=N2)C[NH+]3CCN(CC3)CC4=CC=CC=C4

InChI

InChI=1S/C24H29N5O2/c1-19(14-21-8-5-9-25-15-21)26-24(30)22-18-31-23(27-22)17-29-12-10-28(11-13-29)16-20-6-3-2-4-7-20/h2-9,15,18-19H,10-14,16-17H2,1H3,(H,26,30)/p+1/t19-/m1/s1