3-methyl-4-oxidanylidene-N-[(Z)-(4-piperidin-1-ylphenyl)methylideneamino]phthalazine-1-carboxamide

Systemtic Name: 3-methyl-4-oxidanylidene-N-[(Z)-(4-piperidin-1-ylphenyl)methylideneamino]phthalazine-1-carboxamide Openeye Name: 3-methyl-4-oxo-N-[(Z)-[4-(1-piperidyl)phenyl]methyleneamino]phthalazine-1-carboxamide CAS Name: 3-methyl-4-oxo-N-[(Z)-[4-(1-piperidinyl)phenyl]methylideneamino]-1-phthalazinecarboxamide IUPAC Name: 3-methyl-4-oxo-N-[(Z)-(4-piperidin-1-ylphenyl)methylideneamino]phthalazine-1-carboxamide Traditional Name: 4-keto-3-methyl-N-[(Z)-(4-piperidinobenzylidene)amino]phthalazine-1-carboxamide Formula: C22H23N5O2 MolecularWeight: 389.45032

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=O)C2=CC=CC=C2C(=N1)C(=O)NN=CC3=CC=C(C=C3)N4CCCCC4

Isomeric SMILES

CN1C(=O)C2=CC=CC=C2C(=N1)C(=O)N/N=C\C3=CC=C(C=C3)N4CCCCC4

InChI

InChI=1S/C22H23N5O2/c1-26-22(29)19-8-4-3-7-18(19)20(25-26)21(28)24-23-15-16-9-11-17(12-10-16)27-13-5-2-6-14-27/h3-4,7-12,15H,2,5-6,13-14H2,1H3,(H,24,28)/b23-15-