3-butyl-4-oxidanylidene-N-[(E)-(4-propan-2-ylphenyl)methylideneamino]phthalazine-1-carboxamide

Systemtic Name: 3-butyl-4-oxidanylidene-N-[(E)-(4-propan-2-ylphenyl)methylideneamino]phthalazine-1-carboxamide Openeye Name: 3-butyl-N-[(E)-(4-isopropylphenyl)methyleneamino]-4-oxo-phthalazine-1-carboxamide CAS Name: 3-butyl-4-oxo-N-[(E)-(4-propan-2-ylphenyl)methylideneamino]-1-phthalazinecarboxamide IUPAC Name: 3-butyl-4-oxo-N-[(E)-(4-propan-2-ylphenyl)methylideneamino]phthalazine-1-carboxamide Traditional Name: 3-butyl-N-[(E)-(4-isopropylbenzylidene)amino]-4-keto-phthalazine-1-carboxamide Formula: C23H26N4O2 MolecularWeight: 390.47814

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)NN=CC3=CC=C(C=C3)C(C)C

Isomeric SMILES

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

InChI

InChI=1S/C23H26N4O2/c1-4-5-14-27-23(29)20-9-7-6-8-19(20)21(26-27)22(28)25-24-15-17-10-12-18(13-11-17)16(2)3/h6-13,15-16H,4-5,14H2,1-3H3,(H,25,28)/b24-15+