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

Systemtic Name: 4-oxidanylidene-3-pentyl-N'-[3-(1,2,4-triazol-1-yl)propanoyl]phthalazine-1-carbohydrazide Openeye Name: 4-oxo-3-pentyl-N'-[3-(1,2,4-triazol-1-yl)propanoyl]phthalazine-1-carbohydrazide CAS Name: 4-oxo-N'-[1-oxo-3-(1,2,4-triazol-1-yl)propyl]-3-pentyl-1-phthalazinecarbohydrazide IUPAC Name: 4-oxo-3-pentyl-N'-[3-(1,2,4-triazol-1-yl)propanoyl]phthalazine-1-carbohydrazide Traditional Name: 3-amyl-4-keto-N'-[3-(1,2,4-triazol-1-yl)propanoyl]phthalazine-1-carbohydrazide Formula: C19H23N7O3 MolecularWeight: 397.43102

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)NNC(=O)CCN3C=NC=N3

Isomeric SMILES

CCCCCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)NNC(=O)CCN3C=NC=N3

InChI

InChI=1S/C19H23N7O3/c1-2-3-6-10-26-19(29)15-8-5-4-7-14(15)17(24-26)18(28)23-22-16(27)9-11-25-13-20-12-21-25/h4-5,7-8,12-13H,2-3,6,9-11H2,1H3,(H,22,27)(H,23,28)