1-(3-phenyl-1,2,4-triazin-5-yl)pentan-1-one

Systemtic Name: 1-(3-phenyl-1,2,4-triazin-5-yl)pentan-1-one Openeye Name: 1-(3-phenyl-1,2,4-triazin-5-yl)pentan-1-one CAS Name: 1-(3-phenyl-1,2,4-triazin-5-yl)-1-pentanone IUPAC Name: 1-(3-phenyl-1,2,4-triazin-5-yl)pentan-1-one Traditional Name: 1-(3-phenyl-1,2,4-triazin-5-yl)pentan-1-one Formula: C14H15N3O MolecularWeight: 241.2884

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(=O)C1=CN=NC(=N1)C2=CC=CC=C2

Isomeric SMILES

CCCCC(=O)C1=CN=NC(=N1)C2=CC=CC=C2

InChI

InChI=1S/C14H15N3O/c1-2-3-9-13(18)12-10-15-17-14(16-12)11-7-5-4-6-8-11/h4-8,10H,2-3,9H2,1H3