4-tert-butyl-N-(7-oxidanylidene-5-phenyl-1H-[1,2,4]triazolo[1,5-a]pyrimidin-2-yl)benzamide

Systemtic Name: 4-tert-butyl-N-(7-oxidanylidene-5-phenyl-1H-[1,2,4]triazolo[1,5-a]pyrimidin-2-yl)benzamide Openeye Name: 4-tert-butyl-N-(7-oxo-5-phenyl-1H-[1,2,4]triazolo[1,5-a]pyrimidin-2-yl)benzamide CAS Name: 4-tert-butyl-N-(7-oxo-5-phenyl-1H-[1,2,4]triazolo[1,5-a]pyrimidin-2-yl)benzamide IUPAC Name: 4-tert-butyl-N-(7-oxo-5-phenyl-1H-[1,2,4]triazolo[1,5-a]pyrimidin-2-yl)benzamide Traditional Name: 4-tert-butyl-N-(7-keto-5-phenyl-1H-[1,2,4]triazolo[1,5-a]pyrimidin-2-yl)benzamide Formula: C22H21N5O2 MolecularWeight: 387.43444

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)C(=O)NC2=NC3=NC(=CC(=O)N3N2)C4=CC=CC=C4

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)C(=O)NC2=NC3=NC(=CC(=O)N3N2)C4=CC=CC=C4

InChI

InChI=1S/C22H21N5O2/c1-22(2,3)16-11-9-15(10-12-16)19(29)24-20-25-21-23-17(13-18(28)27(21)26-20)14-7-5-4-6-8-14/h4-13H,1-3H3,(H2,23,24,25,26,29)