N-[(Z)-1-(1-adamantyl)ethylideneamino]-3-methyl-4-oxidanylidene-phthalazine-1-carboxamide

Systemtic Name: N-[(Z)-1-(1-adamantyl)ethylideneamino]-3-methyl-4-oxidanylidene-phthalazine-1-carboxamide Openeye Name: N-[(Z)-1-(1-adamantyl)ethylideneamino]-3-methyl-4-oxo-phthalazine-1-carboxamide CAS Name: N-[(Z)-1-(1-adamantyl)ethylideneamino]-3-methyl-4-oxo-1-phthalazinecarboxamide IUPAC Name: N-[(Z)-1-(1-adamantyl)ethylideneamino]-3-methyl-4-oxophthalazine-1-carboxamide Traditional Name: N-[(Z)-1-(1-adamantyl)ethylideneamino]-4-keto-3-methyl-phthalazine-1-carboxamide Formula: C22H26N4O2 MolecularWeight: 378.46744

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Descriptors Computed from Structure

Canonical SMILES:

CC(=NNC(=O)C1=NN(C(=O)C2=CC=CC=C21)C)C34CC5CC(C3)CC(C5)C4

Isomeric SMILES

C/C(=N/NC(=O)C1=NN(C(=O)C2=CC=CC=C21)C)/C34CC5CC(C3)CC(C5)C4

InChI

InChI=1S/C22H26N4O2/c1-13(22-10-14-7-15(11-22)9-16(8-14)12-22)23-24-20(27)19-17-5-3-4-6-18(17)21(28)26(2)25-19/h3-6,14-16H,7-12H2,1-2H3,(H,24,27)/b23-13-