2-(3-morpholin-4-yl-4-phenyl-1H-1,2,4-triazol-5-ylidene)-3-(4-oxidanylidenecyclohexa-2,5-dien-1-ylidene)propanenitrile

Systemtic Name: 2-(3-morpholin-4-yl-4-phenyl-1H-1,2,4-triazol-5-ylidene)-3-(4-oxidanylidenecyclohexa-2,5-dien-1-ylidene)propanenitrile Openeye Name: 2-(3-morpholino-4-phenyl-1H-1,2,4-triazol-5-ylidene)-3-(4-oxocyclohexa-2,5-dien-1-ylidene)propanenitrile CAS Name: 2-[3-(4-morpholinyl)-4-phenyl-1H-1,2,4-triazol-5-ylidene]-3-(4-oxo-1-cyclohexa-2,5-dienylidene)propanenitrile IUPAC Name: 2-(3-morpholin-4-yl-4-phenyl-1H-1,2,4-triazol-5-ylidene)-3-(4-oxocyclohexa-2,5-dien-1-ylidene)propanenitrile Traditional Name: 3-(4-ketocyclohexa-2,5-dien-1-ylidene)-2-(3-morpholino-4-phenyl-1H-1,2,4-triazol-5-ylidene)propionitrile Formula: C21H19N5O2 MolecularWeight: 373.40786

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1C2=NNC(=C(C=C3C=CC(=O)C=C3)C#N)N2C4=CC=CC=C4

Isomeric SMILES

C1COCCN1C2=NNC(=C(C=C3C=CC(=O)C=C3)C#N)N2C4=CC=CC=C4

InChI

InChI=1S/C21H19N5O2/c22-15-17(14-16-6-8-19(27)9-7-16)20-23-24-21(25-10-12-28-13-11-25)26(20)18-4-2-1-3-5-18/h1-9,14,23H,10-13H2