4-oxidanylidene-N-[(Z)-pentan-2-ylideneamino]-3-(phenylmethyl)phthalazine-1-carboxamide

Systemtic Name: 4-oxidanylidene-N-[(Z)-pentan-2-ylideneamino]-3-(phenylmethyl)phthalazine-1-carboxamide Openeye Name: 3-benzyl-N-[(Z)-1-methylbutylideneamino]-4-oxo-phthalazine-1-carboxamide CAS Name: 4-oxo-N-[(Z)-pentan-2-ylideneamino]-3-(phenylmethyl)-1-phthalazinecarboxamide IUPAC Name: 3-benzyl-4-oxo-N-[(Z)-pentan-2-ylideneamino]phthalazine-1-carboxamide Traditional Name: 3-benzyl-4-keto-N-[(Z)-1-methylbutylideneamino]phthalazine-1-carboxamide Formula: C21H22N4O2 MolecularWeight: 362.42498

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=NNC(=O)C1=NN(C(=O)C2=CC=CC=C21)CC3=CC=CC=C3)C

Isomeric SMILES

CCC/C(=N\NC(=O)C1=NN(C(=O)C2=CC=CC=C21)CC3=CC=CC=C3)/C

InChI

InChI=1S/C21H22N4O2/c1-3-9-15(2)22-23-20(26)19-17-12-7-8-13-18(17)21(27)25(24-19)14-16-10-5-4-6-11-16/h4-8,10-13H,3,9,14H2,1-2H3,(H,23,26)/b22-15-