N-[(Z)-1-(4-aminophenyl)ethylideneamino]-3-butyl-4-oxidanylidene-phthalazine-1-carboxamide

Systemtic Name: N-[(Z)-1-(4-aminophenyl)ethylideneamino]-3-butyl-4-oxidanylidene-phthalazine-1-carboxamide Openeye Name: N-[(Z)-1-(4-aminophenyl)ethylideneamino]-3-butyl-4-oxo-phthalazine-1-carboxamide CAS Name: N-[(Z)-1-(4-aminophenyl)ethylideneamino]-3-butyl-4-oxo-1-phthalazinecarboxamide IUPAC Name: N-[(Z)-1-(4-aminophenyl)ethylideneamino]-3-butyl-4-oxophthalazine-1-carboxamide Traditional Name: N-[(Z)-1-(4-aminophenyl)ethylideneamino]-3-butyl-4-keto-phthalazine-1-carboxamide Formula: C21H23N5O2 MolecularWeight: 377.43962

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)NN=C(C)C3=CC=C(C=C3)N

Isomeric SMILES

CCCCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)N/N=C(/C)\C3=CC=C(C=C3)N

InChI

InChI=1S/C21H23N5O2/c1-3-4-13-26-21(28)18-8-6-5-7-17(18)19(25-26)20(27)24-23-14(2)15-9-11-16(22)12-10-15/h5-12H,3-4,13,22H2,1-2H3,(H,24,27)/b23-14-