4-oxidanylidene-3-pentyl-N'-[2-(1,2,4-triazol-1-yl)ethanoyl]phthalazine-1-carbohydrazide

Systemtic Name: 4-oxidanylidene-3-pentyl-N'-[2-(1,2,4-triazol-1-yl)ethanoyl]phthalazine-1-carbohydrazide Openeye Name: 4-oxo-3-pentyl-N'-[2-(1,2,4-triazol-1-yl)acetyl]phthalazine-1-carbohydrazide CAS Name: 4-oxo-N'-[1-oxo-2-(1,2,4-triazol-1-yl)ethyl]-3-pentyl-1-phthalazinecarbohydrazide IUPAC Name: 4-oxo-3-pentyl-N'-[2-(1,2,4-triazol-1-yl)acetyl]phthalazine-1-carbohydrazide Traditional Name: 3-amyl-4-keto-N'-[2-(1,2,4-triazol-1-yl)acetyl]phthalazine-1-carbohydrazide Formula: C18H21N7O3 MolecularWeight: 383.40444

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)NNC(=O)CN3C=NC=N3

Isomeric SMILES

CCCCCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)NNC(=O)CN3C=NC=N3

InChI

InChI=1S/C18H21N7O3/c1-2-3-6-9-25-18(28)14-8-5-4-7-13(14)16(23-25)17(27)22-21-15(26)10-24-12-19-11-20-24/h4-5,7-8,11-12H,2-3,6,9-10H2,1H3,(H,21,26)(H,22,27)