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

Systemtic Name: N-[(Z)-2-methylpentan-3-ylideneamino]-4-oxidanylidene-3-(phenylmethyl)phthalazine-1-carboxamide Openeye Name: 3-benzyl-N-[(Z)-(1-ethyl-2-methyl-propylidene)amino]-4-oxo-phthalazine-1-carboxamide CAS Name: N-[(Z)-2-methylpentan-3-ylideneamino]-4-oxo-3-(phenylmethyl)-1-phthalazinecarboxamide IUPAC Name: 3-benzyl-N-[(Z)-2-methylpentan-3-ylideneamino]-4-oxophthalazine-1-carboxamide Traditional Name: 3-benzyl-N-[(Z)-(1-ethyl-2-methyl-propylidene)amino]-4-keto-phthalazine-1-carboxamide Formula: C22H24N4O2 MolecularWeight: 376.45156

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H24N4O2/c1-4-19(15(2)3)23-24-21(27)20-17-12-8-9-13-18(17)22(28)26(25-20)14-16-10-6-5-7-11-16/h5-13,15H,4,14H2,1-3H3,(H,24,27)/b23-19-