3-butyl-N-(3-cyanophenyl)-4-oxidanylidene-phthalazine-1-carboxamide

Systemtic Name: 3-butyl-N-(3-cyanophenyl)-4-oxidanylidene-phthalazine-1-carboxamide Openeye Name: 3-butyl-N-(3-cyanophenyl)-4-oxo-phthalazine-1-carboxamide CAS Name: 3-butyl-N-(3-cyanophenyl)-4-oxo-1-phthalazinecarboxamide IUPAC Name: 3-butyl-N-(3-cyanophenyl)-4-oxophthalazine-1-carboxamide Traditional Name: 3-butyl-N-(3-cyanophenyl)-4-keto-phthalazine-1-carboxamide Formula: C20H18N4O2 MolecularWeight: 346.38252

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)NC3=CC=CC(=C3)C#N

Isomeric SMILES

CCCCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)NC3=CC=CC(=C3)C#N

InChI

InChI=1S/C20H18N4O2/c1-2-3-11-24-20(26)17-10-5-4-9-16(17)18(23-24)19(25)22-15-8-6-7-14(12-15)13-21/h4-10,12H,2-3,11H2,1H3,(H,22,25)