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

Systemtic Name: 3-(3-methylbutyl)-4-oxidanylidene-N-[(Z)-quinoxalin-2-ylmethylideneamino]phthalazine-1-carboxamide Openeye Name: 3-isopentyl-4-oxo-N-[(Z)-quinoxalin-2-ylmethyleneamino]phthalazine-1-carboxamide CAS Name: 3-(3-methylbutyl)-4-oxo-N-[(Z)-2-quinoxalinylmethylideneamino]-1-phthalazinecarboxamide IUPAC Name: 3-(3-methylbutyl)-4-oxo-N-[(Z)-quinoxalin-2-ylmethylideneamino]phthalazine-1-carboxamide Traditional Name: 3-isoamyl-4-keto-N-[(Z)-quinoxalin-2-ylmethyleneamino]phthalazine-1-carboxamide Formula: C23H22N6O2 MolecularWeight: 414.45978

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)NN=CC3=NC4=CC=CC=C4N=C3

Isomeric SMILES

CC(C)CCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)N/N=C\C3=NC4=CC=CC=C4N=C3

InChI

InChI=1S/C23H22N6O2/c1-15(2)11-12-29-23(31)18-8-4-3-7-17(18)21(28-29)22(30)27-25-14-16-13-24-19-9-5-6-10-20(19)26-16/h3-10,13-15H,11-12H2,1-2H3,(H,27,30)/b25-14-