N-[(Z)-1-(2-methylphenyl)ethylideneamino]-4-oxidanylidene-3-propyl-phthalazine-1-carboxamide

Systemtic Name: N-[(Z)-1-(2-methylphenyl)ethylideneamino]-4-oxidanylidene-3-propyl-phthalazine-1-carboxamide Openeye Name: N-[(Z)-1-(o-tolyl)ethylideneamino]-4-oxo-3-propyl-phthalazine-1-carboxamide CAS Name: N-[(Z)-1-(2-methylphenyl)ethylideneamino]-4-oxo-3-propyl-1-phthalazinecarboxamide IUPAC Name: N-[(Z)-1-(2-methylphenyl)ethylideneamino]-4-oxo-3-propylphthalazine-1-carboxamide Traditional Name: 4-keto-N-[(Z)-1-(o-tolyl)ethylideneamino]-3-propyl-phthalazine-1-carboxamide Formula: C21H22N4O2 MolecularWeight: 362.42498

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)NN=C(C)C3=CC=CC=C3C

Isomeric SMILES

CCCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)N/N=C(/C)\C3=CC=CC=C3C

InChI

InChI=1S/C21H22N4O2/c1-4-13-25-21(27)18-12-8-7-11-17(18)19(24-25)20(26)23-22-15(3)16-10-6-5-9-14(16)2/h5-12H,4,13H2,1-3H3,(H,23,26)/b22-15-