3-[5-[(3-tert-butyl-5-cyano-phenyl)carbonylamino]-2-methyl-phenyl]-N-morpholin-4-yl-1,2-oxazole-5-carboxamide

Systemtic Name: 3-[5-[(3-tert-butyl-5-cyano-phenyl)carbonylamino]-2-methyl-phenyl]-N-morpholin-4-yl-1,2-oxazole-5-carboxamide Openeye Name: 3-[5-[(3-tert-butyl-5-cyano-benzoyl)amino]-2-methyl-phenyl]-N-morpholino-isoxazole-5-carboxamide CAS Name: 3-[5-[[(3-tert-butyl-5-cyanophenyl)-oxomethyl]amino]-2-methylphenyl]-N-(4-morpholinyl)-5-isoxazolecarboxamide IUPAC Name: 3-[5-[(3-tert-butyl-5-cyanobenzoyl)amino]-2-methylphenyl]-N-morpholin-4-yl-1,2-oxazole-5-carboxamide Traditional Name: 3-[5-[(3-tert-butyl-5-cyano-benzoyl)amino]-2-methyl-phenyl]-N-morpholino-isoxazole-5-carboxamide Formula: C27H29N5O4 MolecularWeight: 487.55026

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=O)C2=CC(=CC(=C2)C#N)C(C)(C)C)C3=NOC(=C3)C(=O)NN4CCOCC4

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=O)C2=CC(=CC(=C2)C#N)C(C)(C)C)C3=NOC(=C3)C(=O)NN4CCOCC4

InChI

InChI=1S/C27H29N5O4/c1-17-5-6-21(29-25(33)19-11-18(16-28)12-20(13-19)27(2,3)4)14-22(17)23-15-24(36-31-23)26(34)30-32-7-9-35-10-8-32/h5-6,11-15H,7-10H2,1-4H3,(H,29,33)(H,30,34)