3-butyl-4-oxidanylidene-N-([1,2,4]triazolo[4,3-a]pyridin-3-ylmethyl)phthalazine-1-carboxamide

Systemtic Name: 3-butyl-4-oxidanylidene-N-([1,2,4]triazolo[4,3-a]pyridin-3-ylmethyl)phthalazine-1-carboxamide Openeye Name: 3-butyl-4-oxo-N-([1,2,4]triazolo[4,3-a]pyridin-3-ylmethyl)phthalazine-1-carboxamide CAS Name: 3-butyl-4-oxo-N-([1,2,4]triazolo[4,3-a]pyridin-3-ylmethyl)-1-phthalazinecarboxamide IUPAC Name: 3-butyl-4-oxo-N-([1,2,4]triazolo[4,3-a]pyridin-3-ylmethyl)phthalazine-1-carboxamide Traditional Name: 3-butyl-4-keto-N-([1,2,4]triazolo[4,3-a]pyridin-3-ylmethyl)phthalazine-1-carboxamide Formula: C20H20N6O2 MolecularWeight: 376.4118

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)NCC3=NN=C4N3C=CC=C4

Isomeric SMILES

CCCCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)NCC3=NN=C4N3C=CC=C4

InChI

InChI=1S/C20H20N6O2/c1-2-3-12-26-20(28)15-9-5-4-8-14(15)18(24-26)19(27)21-13-17-23-22-16-10-6-7-11-25(16)17/h4-11H,2-3,12-13H2,1H3,(H,21,27)