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

Systemtic Name: 2-(1,3-dihydrobenzimidazol-2-ylidene)-4-[3-(4-fluorophenyl)-4-oxidanylidene-quinazolin-2-yl]sulfanyl-3-oxidanylidene-butanenitrile Openeye Name: 2-(1,3-dihydrobenzimidazol-2-ylidene)-4-[3-(4-fluorophenyl)-4-oxo-quinazolin-2-yl]sulfanyl-3-oxo-butanenitrile CAS Name: 2-(1,3-dihydrobenzimidazol-2-ylidene)-4-[[3-(4-fluorophenyl)-4-oxo-2-quinazolinyl]thio]-3-oxobutanenitrile IUPAC Name: 2-(1,3-dihydrobenzimidazol-2-ylidene)-4-[3-(4-fluorophenyl)-4-oxoquinazolin-2-yl]sulfanyl-3-oxobutanenitrile Traditional Name: 2-(1,3-dihydrobenzimidazol-2-ylidene)-4-[[3-(4-fluorophenyl)-4-keto-quinazolin-2-yl]thio]-3-keto-butyronitrile Formula: C25H16FN5O2S MolecularWeight: 469.490243

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)N(C(=N2)SCC(=O)C(=C3NC4=CC=CC=C4N3)C#N)C5=CC=C(C=C5)F

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)N(C(=N2)SCC(=O)C(=C3NC4=CC=CC=C4N3)C#N)C5=CC=C(C=C5)F

InChI

InChI=1S/C25H16FN5O2S/c26-15-9-11-16(12-10-15)31-24(33)17-5-1-2-6-19(17)30-25(31)34-14-22(32)18(13-27)23-28-20-7-3-4-8-21(20)29-23/h1-12,28-29H,14H2