3-butyl-4-oxidanylidene-N-[(Z)-quinoxalin-2-ylmethylideneamino]phthalazine-1-carboxamide

Systemtic Name: 3-butyl-4-oxidanylidene-N-[(Z)-quinoxalin-2-ylmethylideneamino]phthalazine-1-carboxamide Openeye Name: 3-butyl-4-oxo-N-[(Z)-quinoxalin-2-ylmethyleneamino]phthalazine-1-carboxamide CAS Name: 3-butyl-4-oxo-N-[(Z)-2-quinoxalinylmethylideneamino]-1-phthalazinecarboxamide IUPAC Name: 3-butyl-4-oxo-N-[(Z)-quinoxalin-2-ylmethylideneamino]phthalazine-1-carboxamide Traditional Name: 3-butyl-4-keto-N-[(Z)-quinoxalin-2-ylmethyleneamino]phthalazine-1-carboxamide Formula: C22H20N6O2 MolecularWeight: 400.4332

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)NN=CC3=NC4=CC=CC=C4N=C3

Isomeric SMILES

CCCCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)N/N=C\C3=NC4=CC=CC=C4N=C3

InChI

InChI=1S/C22H20N6O2/c1-2-3-12-28-22(30)17-9-5-4-8-16(17)20(27-28)21(29)26-24-14-15-13-23-18-10-6-7-11-19(18)25-15/h4-11,13-14H,2-3,12H2,1H3,(H,26,29)/b24-14-