2-(1,3-dihydrobenzimidazol-2-ylidene)-3-oxidanylidene-4-[4-oxidanylidene-3-(3-phenylpropyl)quinazolin-2-yl]sulfanyl-butanenitrile

Systemtic Name: 2-(1,3-dihydrobenzimidazol-2-ylidene)-3-oxidanylidene-4-[4-oxidanylidene-3-(3-phenylpropyl)quinazolin-2-yl]sulfanyl-butanenitrile Openeye Name: 2-(1,3-dihydrobenzimidazol-2-ylidene)-3-oxo-4-[4-oxo-3-(3-phenylpropyl)quinazolin-2-yl]sulfanyl-butanenitrile CAS Name: 2-(1,3-dihydrobenzimidazol-2-ylidene)-3-oxo-4-[[4-oxo-3-(3-phenylpropyl)-2-quinazolinyl]thio]butanenitrile IUPAC Name: 2-(1,3-dihydrobenzimidazol-2-ylidene)-3-oxo-4-[4-oxo-3-(3-phenylpropyl)quinazolin-2-yl]sulfanylbutanenitrile Traditional Name: 2-(1,3-dihydrobenzimidazol-2-ylidene)-3-keto-4-[[4-keto-3-(3-phenylpropyl)quinazolin-2-yl]thio]butyronitrile Formula: C28H23N5O2S MolecularWeight: 493.57952

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCCN2C(=O)C3=CC=CC=C3N=C2SCC(=O)C(=C4NC5=CC=CC=C5N4)C#N

Isomeric SMILES

C1=CC=C(C=C1)CCCN2C(=O)C3=CC=CC=C3N=C2SCC(=O)C(=C4NC5=CC=CC=C5N4)C#N

InChI

InChI=1S/C28H23N5O2S/c29-17-21(26-30-23-14-6-7-15-24(23)31-26)25(34)18-36-28-32-22-13-5-4-12-20(22)27(35)33(28)16-8-11-19-9-2-1-3-10-19/h1-7,9-10,12-15,30-31H,8,11,16,18H2