N-(5-oxidanylidene-2-pyridin-3-yl-1H-[1,2,4]triazolo[1,5-a]pyrimidin-7-yl)-2-phenyl-butanamide

Systemtic Name: N-(5-oxidanylidene-2-pyridin-3-yl-1H-[1,2,4]triazolo[1,5-a]pyrimidin-7-yl)-2-phenyl-butanamide Openeye Name: N-[5-oxo-2-(3-pyridyl)-1H-[1,2,4]triazolo[1,5-a]pyrimidin-7-yl]-2-phenyl-butanamide CAS Name: N-[5-oxo-2-(3-pyridinyl)-1H-[1,2,4]triazolo[1,5-a]pyrimidin-7-yl]-2-phenylbutanamide IUPAC Name: N-(5-oxo-2-pyridin-3-yl-1H-[1,2,4]triazolo[1,5-a]pyrimidin-7-yl)-2-phenylbutanamide Traditional Name: N-[5-keto-2-(3-pyridyl)-1H-[1,2,4]triazolo[1,5-a]pyrimidin-7-yl]-2-phenyl-butyramide Formula: C20H18N6O2 MolecularWeight: 374.39592

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C1=CC=CC=C1)C(=O)NC2=CC(=O)N=C3N2NC(=N3)C4=CN=CC=C4

Isomeric SMILES

CCC(C1=CC=CC=C1)C(=O)NC2=CC(=O)N=C3N2NC(=N3)C4=CN=CC=C4

InChI

InChI=1S/C20H18N6O2/c1-2-15(13-7-4-3-5-8-13)19(28)22-16-11-17(27)23-20-24-18(25-26(16)20)14-9-6-10-21-12-14/h3-12,15H,2H2,1H3,(H,22,28)(H,23,24,25,27)