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

Systemtic Name: 2-(1,3-dihydrobenzimidazol-2-ylidene)-4-[3-(2-fluorophenyl)-4-oxidanylidene-quinazolin-2-yl]sulfanyl-3-oxidanylidene-butanenitrile Openeye Name: 2-(1,3-dihydrobenzimidazol-2-ylidene)-4-[3-(2-fluorophenyl)-4-oxo-quinazolin-2-yl]sulfanyl-3-oxo-butanenitrile CAS Name: 2-(1,3-dihydrobenzimidazol-2-ylidene)-4-[[3-(2-fluorophenyl)-4-oxo-2-quinazolinyl]thio]-3-oxobutanenitrile IUPAC Name: 2-(1,3-dihydrobenzimidazol-2-ylidene)-4-[3-(2-fluorophenyl)-4-oxoquinazolin-2-yl]sulfanyl-3-oxobutanenitrile Traditional Name: 2-(1,3-dihydrobenzimidazol-2-ylidene)-4-[[3-(2-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=CC=C5F

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)N(C(=N2)SCC(=O)C(=C3NC4=CC=CC=C4N3)C#N)C5=CC=CC=C5F

InChI

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