3-methyl-4-oxidanylidene-N-[(Z)-1-(2,4,6-trimethylphenyl)ethylideneamino]phthalazine-1-carboxamide

Systemtic Name: 3-methyl-4-oxidanylidene-N-[(Z)-1-(2,4,6-trimethylphenyl)ethylideneamino]phthalazine-1-carboxamide Openeye Name: 3-methyl-4-oxo-N-[(Z)-1-(2,4,6-trimethylphenyl)ethylideneamino]phthalazine-1-carboxamide CAS Name: 3-methyl-4-oxo-N-[(Z)-1-(2,4,6-trimethylphenyl)ethylideneamino]-1-phthalazinecarboxamide IUPAC Name: 3-methyl-4-oxo-N-[(Z)-1-(2,4,6-trimethylphenyl)ethylideneamino]phthalazine-1-carboxamide Traditional Name: 4-keto-N-[(Z)-1-mesitylethylideneamino]-3-methyl-phthalazine-1-carboxamide Formula: C21H22N4O2 MolecularWeight: 362.42498

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)C)C(=NNC(=O)C2=NN(C(=O)C3=CC=CC=C32)C)C)C

Isomeric SMILES

CC1=CC(=C(C(=C1)C)/C(=N\NC(=O)C2=NN(C(=O)C3=CC=CC=C32)C)/C)C

InChI

InChI=1S/C21H22N4O2/c1-12-10-13(2)18(14(3)11-12)15(4)22-23-20(26)19-16-8-6-7-9-17(16)21(27)25(5)24-19/h6-11H,1-5H3,(H,23,26)/b22-15-