3-[3-oxidanylidene-4-phenyl-4-(phenylmethyl)-1,2-diazinan-1-yl]benzenecarbonitrile

Systemtic Name: 3-[3-oxidanylidene-4-phenyl-4-(phenylmethyl)-1,2-diazinan-1-yl]benzenecarbonitrile Openeye Name: 3-(4-benzyl-3-oxo-4-phenyl-hexahydropyridazin-1-yl)benzonitrile CAS Name: 3-[3-oxo-4-phenyl-4-(phenylmethyl)-1-diazinanyl]benzonitrile IUPAC Name: 3-(4-benzyl-3-oxo-4-phenyldiazinan-1-yl)benzonitrile Traditional Name: 3-(4-benzyl-3-keto-4-phenyl-hexahydropyridazin-1-yl)benzonitrile Formula: C24H21N3O MolecularWeight: 367.44304

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(NC(=O)C1(CC2=CC=CC=C2)C3=CC=CC=C3)C4=CC=CC(=C4)C#N

Isomeric SMILES

C1CN(NC(=O)C1(CC2=CC=CC=C2)C3=CC=CC=C3)C4=CC=CC(=C4)C#N

InChI

InChI=1S/C24H21N3O/c25-18-20-10-7-13-22(16-20)27-15-14-24(23(28)26-27,21-11-5-2-6-12-21)17-19-8-3-1-4-9-19/h1-13,16H,14-15,17H2,(H,26,28)