(2E)-2-[(4-methylphenyl)hydrazinylidene]-2-(5-morpholin-4-yl-4-phenyl-1,2,4-triazol-3-yl)ethanenitrile

Systemtic Name: (2E)-2-[(4-methylphenyl)hydrazinylidene]-2-(5-morpholin-4-yl-4-phenyl-1,2,4-triazol-3-yl)ethanenitrile Openeye Name: (3E)-N-(4-methylanilino)-5-morpholino-4-phenyl-1,2,4-triazole-3-carboximidoyl cyanide CAS Name: (2E)-2-[(4-methylphenyl)hydrazinylidene]-2-[5-(4-morpholinyl)-4-phenyl-1,2,4-triazol-3-yl]acetonitrile IUPAC Name: (3E)-N-(4-methylanilino)-5-morpholin-4-yl-4-phenyl-1,2,4-triazole-3-carboximidoyl cyanide Traditional Name: (2E)-2-(5-morpholino-4-phenyl-1,2,4-triazol-3-yl)-2-(p-tolylhydrazono)acetonitrile Formula: C21H21N7O MolecularWeight: 387.43774

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)NN=C(C#N)C2=NN=C(N2C3=CC=CC=C3)N4CCOCC4

Isomeric SMILES

CC1=CC=C(C=C1)N/N=C(\C#N)/C2=NN=C(N2C3=CC=CC=C3)N4CCOCC4

InChI

InChI=1S/C21H21N7O/c1-16-7-9-17(10-8-16)23-24-19(15-22)20-25-26-21(27-11-13-29-14-12-27)28(20)18-5-3-2-4-6-18/h2-10,23H,11-14H2,1H3/b24-19+