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

Systemtic Name: 5-(2,5-dimethylphenyl)-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-(2,5-dimethylphenyl)isoxazole-3-carboxamide CAS Name: 5-(2,5-dimethylphenyl)-N-[1-(4-methyl-1-piperazinyl)-1-oxo-3-phenylpropan-2-yl]-3-isoxazolecarboxamide IUPAC Name: 5-(2,5-dimethylphenyl)-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-(2,5-dimethylphenyl)isoxazole-3-carboxamide Formula: C26H30N4O3 MolecularWeight: 446.5414

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C26H30N4O3/c1-18-9-10-19(2)21(15-18)24-17-22(28-33-24)25(31)27-23(16-20-7-5-4-6-8-20)26(32)30-13-11-29(3)12-14-30/h4-10,15,17,23H,11-14,16H2,1-3H3,(H,27,31)