N-(2-cyanoaziridin-1-yl)carbonyl-5-methyl-3-phenyl-1,2-oxazole-4-carboxamide

Systemtic Name: N-(2-cyanoaziridin-1-yl)carbonyl-5-methyl-3-phenyl-1,2-oxazole-4-carboxamide Openeye Name: N-(2-cyanoaziridine-1-carbonyl)-5-methyl-3-phenyl-isoxazole-4-carboxamide CAS Name: N-[(2-cyano-1-aziridinyl)-oxomethyl]-5-methyl-3-phenyl-4-isoxazolecarboxamide IUPAC Name: N-(2-cyanoaziridine-1-carbonyl)-5-methyl-3-phenyl-1,2-oxazole-4-carboxamide Traditional Name: N-(2-cyanoethylenimine-1-carbonyl)-5-methyl-3-phenyl-isoxazole-4-carboxamide Formula: C15H12N4O3 MolecularWeight: 296.28078

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NO1)C2=CC=CC=C2)C(=O)NC(=O)N3CC3C#N

Isomeric SMILES

CC1=C(C(=NO1)C2=CC=CC=C2)C(=O)NC(=O)N3CC3C#N

InChI

InChI=1S/C15H12N4O3/c1-9-12(13(18-22-9)10-5-3-2-4-6-10)14(20)17-15(21)19-8-11(19)7-16/h2-6,11H,8H2,1H3,(H,17,20,21)