5-(4-methylphenyl)-N-[1-(4-methylpiperazin-1-yl)-1-oxidanylidene-3-phenyl-propan-2-yl]-1,2-oxazole-3-carboxamide

Systemtic Name: 5-(4-methylphenyl)-N-[1-(4-methylpiperazin-1-yl)-1-oxidanylidene-3-phenyl-propan-2-yl]-1,2-oxazole-3-carboxamide Openeye Name: N-[1-benzyl-2-(4-methylpiperazin-1-yl)-2-oxo-ethyl]-5-(p-tolyl)isoxazole-3-carboxamide CAS Name: 5-(4-methylphenyl)-N-[1-(4-methyl-1-piperazinyl)-1-oxo-3-phenylpropan-2-yl]-3-isoxazolecarboxamide IUPAC Name: 5-(4-methylphenyl)-N-[1-(4-methylpiperazin-1-yl)-1-oxo-3-phenylpropan-2-yl]-1,2-oxazole-3-carboxamide Traditional Name: N-[1-benzyl-2-keto-2-(4-methylpiperazino)ethyl]-5-(p-tolyl)isoxazole-3-carboxamide Formula: C25H28N4O3 MolecularWeight: 432.51482

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=CC(=NO2)C(=O)NC(CC3=CC=CC=C3)C(=O)N4CCN(CC4)C

Isomeric SMILES

CC1=CC=C(C=C1)C2=CC(=NO2)C(=O)NC(CC3=CC=CC=C3)C(=O)N4CCN(CC4)C

InChI

InChI=1S/C25H28N4O3/c1-18-8-10-20(11-9-18)23-17-21(27-32-23)24(30)26-22(16-19-6-4-3-5-7-19)25(31)29-14-12-28(2)13-15-29/h3-11,17,22H,12-16H2,1-2H3,(H,26,30)