N-(5-methylpyridin-2-yl)-4-oxidanylidene-3-propyl-phthalazine-1-carboxamide

Systemtic Name: N-(5-methylpyridin-2-yl)-4-oxidanylidene-3-propyl-phthalazine-1-carboxamide Openeye Name: N-(5-methyl-2-pyridyl)-4-oxo-3-propyl-phthalazine-1-carboxamide CAS Name: N-(5-methyl-2-pyridinyl)-4-oxo-3-propyl-1-phthalazinecarboxamide IUPAC Name: N-(5-methylpyridin-2-yl)-4-oxo-3-propylphthalazine-1-carboxamide Traditional Name: 4-keto-N-(5-methyl-2-pyridyl)-3-propyl-phthalazine-1-carboxamide Formula: C18H18N4O2 MolecularWeight: 322.36112

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)NC3=NC=C(C=C3)C

Isomeric SMILES

CCCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)NC3=NC=C(C=C3)C

InChI

InChI=1S/C18H18N4O2/c1-3-10-22-18(24)14-7-5-4-6-13(14)16(21-22)17(23)20-15-9-8-12(2)11-19-15/h4-9,11H,3,10H2,1-2H3,(H,19,20,23)