N'-[cyano-(3,4-dimethoxyphenyl)methyl]-4-(4-oxidanylidene-2-phenyl-quinazolin-3-yl)benzohydrazide

Systemtic Name: N'-[cyano-(3,4-dimethoxyphenyl)methyl]-4-(4-oxidanylidene-2-phenyl-quinazolin-3-yl)benzohydrazide Openeye Name: N'-[cyano-(3,4-dimethoxyphenyl)methyl]-4-(4-oxo-2-phenyl-quinazolin-3-yl)benzohydrazide CAS Name: N'-[cyano-(3,4-dimethoxyphenyl)methyl]-4-(4-oxo-2-phenyl-3-quinazolinyl)benzohydrazide IUPAC Name: N'-[cyano-(3,4-dimethoxyphenyl)methyl]-4-(4-oxo-2-phenylquinazolin-3-yl)benzohydrazide Traditional Name: N'-[cyano-(3,4-dimethoxyphenyl)methyl]-4-(4-keto-2-phenyl-quinazolin-3-yl)benzohydrazide Formula: C31H25N5O4 MolecularWeight: 531.5613

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(C#N)NNC(=O)C2=CC=C(C=C2)N3C(=NC4=CC=CC=C4C3=O)C5=CC=CC=C5)OC

Isomeric SMILES

COC1=C(C=C(C=C1)C(C#N)NNC(=O)C2=CC=C(C=C2)N3C(=NC4=CC=CC=C4C3=O)C5=CC=CC=C5)OC

InChI

InChI=1S/C31H25N5O4/c1-39-27-17-14-22(18-28(27)40-2)26(19-32)34-35-30(37)21-12-15-23(16-13-21)36-29(20-8-4-3-5-9-20)33-25-11-7-6-10-24(25)31(36)38/h3-18,26,34H,1-2H3,(H,35,37)