2-(1,3-dihydrobenzimidazol-2-ylidene)-3-oxidanylidene-4-(4-phenylquinazolin-2-yl)sulfanyl-butanenitrile

Systemtic Name: 2-(1,3-dihydrobenzimidazol-2-ylidene)-3-oxidanylidene-4-(4-phenylquinazolin-2-yl)sulfanyl-butanenitrile Openeye Name: 2-(1,3-dihydrobenzimidazol-2-ylidene)-3-oxo-4-(4-phenylquinazolin-2-yl)sulfanyl-butanenitrile CAS Name: 2-(1,3-dihydrobenzimidazol-2-ylidene)-3-oxo-4-[(4-phenyl-2-quinazolinyl)thio]butanenitrile IUPAC Name: 2-(1,3-dihydrobenzimidazol-2-ylidene)-3-oxo-4-(4-phenylquinazolin-2-yl)sulfanylbutanenitrile Traditional Name: 2-(1,3-dihydrobenzimidazol-2-ylidene)-3-keto-4-[(4-phenylquinazolin-2-yl)thio]butyronitrile Formula: C25H17N5OS MolecularWeight: 435.50038

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=NC(=NC3=CC=CC=C32)SCC(=O)C(=C4NC5=CC=CC=C5N4)C#N

Isomeric SMILES

C1=CC=C(C=C1)C2=NC(=NC3=CC=CC=C32)SCC(=O)C(=C4NC5=CC=CC=C5N4)C#N

InChI

InChI=1S/C25H17N5OS/c26-14-18(24-27-20-12-6-7-13-21(20)28-24)22(31)15-32-25-29-19-11-5-4-10-17(19)23(30-25)16-8-2-1-3-9-16/h1-13,27-28H,15H2