3-(5-methyl-7-oxidanylidene-2-phenyl-1H-[1,2,4]triazolo[1,5-a]pyrimidin-6-yl)propanenitrile

Systemtic Name: 3-(5-methyl-7-oxidanylidene-2-phenyl-1H-[1,2,4]triazolo[1,5-a]pyrimidin-6-yl)propanenitrile Openeye Name: 3-(5-methyl-7-oxo-2-phenyl-1H-[1,2,4]triazolo[1,5-a]pyrimidin-6-yl)propanenitrile CAS Name: 3-(5-methyl-7-oxo-2-phenyl-1H-[1,2,4]triazolo[1,5-a]pyrimidin-6-yl)propanenitrile IUPAC Name: 3-(5-methyl-7-oxo-2-phenyl-1H-[1,2,4]triazolo[1,5-a]pyrimidin-6-yl)propanenitrile Traditional Name: 3-(7-keto-5-methyl-2-phenyl-1H-[1,2,4]triazolo[1,5-a]pyrimidin-6-yl)propionitrile Formula: C15H13N5O MolecularWeight: 279.29662

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)N2C(=N1)N=C(N2)C3=CC=CC=C3)CCC#N

Isomeric SMILES

CC1=C(C(=O)N2C(=N1)N=C(N2)C3=CC=CC=C3)CCC#N

InChI

InChI=1S/C15H13N5O/c1-10-12(8-5-9-16)14(21)20-15(17-10)18-13(19-20)11-6-3-2-4-7-11/h2-4,6-7H,5,8H2,1H3,(H,17,18,19)