N-[(2S)-2-(4-ethylpiperazin-4-ium-1-yl)-2-phenyl-ethyl]-5-phenyl-1,2-oxazole-3-carboxamide

Systemtic Name: N-[(2S)-2-(4-ethylpiperazin-4-ium-1-yl)-2-phenyl-ethyl]-5-phenyl-1,2-oxazole-3-carboxamide Openeye Name: N-[(2S)-2-(4-ethylpiperazin-4-ium-1-yl)-2-phenyl-ethyl]-5-phenyl-isoxazole-3-carboxamide CAS Name: N-[(2S)-2-(4-ethyl-1-piperazin-4-iumyl)-2-phenylethyl]-5-phenyl-3-isoxazolecarboxamide IUPAC Name: N-[(2S)-2-(4-ethylpiperazin-4-ium-1-yl)-2-phenylethyl]-5-phenyl-1,2-oxazole-3-carboxamide Traditional Name: N-[(2S)-2-(4-ethylpiperazin-4-ium-1-yl)-2-phenyl-ethyl]-5-phenyl-isoxazole-3-carboxamide Formula: C24H29N4O2+ MolecularWeight: 405.51266

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+]1CCN(CC1)C(CNC(=O)C2=NOC(=C2)C3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

CC[NH+]1CCN(CC1)[C@H](CNC(=O)C2=NOC(=C2)C3=CC=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C24H28N4O2/c1-2-27-13-15-28(16-14-27)22(19-9-5-3-6-10-19)18-25-24(29)21-17-23(30-26-21)20-11-7-4-8-12-20/h3-12,17,22H,2,13-16,18H2,1H3,(H,25,29)/p+1/t22-/m1/s1