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

Systemtic Name: 2-(1,3-dihydrobenzimidazol-2-ylidene)-3-oxidanylidene-4-[4-oxidanylidene-3-[[(2R)-oxolan-2-yl]methyl]quinazolin-2-yl]sulfanyl-butanenitrile Openeye Name: 2-(1,3-dihydrobenzimidazol-2-ylidene)-3-oxo-4-[4-oxo-3-[[(2R)-tetrahydrofuran-2-yl]methyl]quinazolin-2-yl]sulfanyl-butanenitrile CAS Name: 2-(1,3-dihydrobenzimidazol-2-ylidene)-3-oxo-4-[[4-oxo-3-[[(2R)-2-oxolanyl]methyl]-2-quinazolinyl]thio]butanenitrile IUPAC Name: 2-(1,3-dihydrobenzimidazol-2-ylidene)-3-oxo-4-[4-oxo-3-[[(2R)-oxolan-2-yl]methyl]quinazolin-2-yl]sulfanylbutanenitrile Traditional Name: 2-(1,3-dihydrobenzimidazol-2-ylidene)-3-keto-4-[[4-keto-3-[[(2R)-tetrahydrofuran-2-yl]methyl]quinazolin-2-yl]thio]butyronitrile Formula: C24H21N5O3S MolecularWeight: 459.52024

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(OC1)CN2C(=O)C3=CC=CC=C3N=C2SCC(=O)C(=C4NC5=CC=CC=C5N4)C#N

Isomeric SMILES

C1C[C@@H](OC1)CN2C(=O)C3=CC=CC=C3N=C2SCC(=O)C(=C4NC5=CC=CC=C5N4)C#N

InChI

InChI=1S/C24H21N5O3S/c25-12-17(22-26-19-9-3-4-10-20(19)27-22)21(30)14-33-24-28-18-8-2-1-7-16(18)23(31)29(24)13-15-6-5-11-32-15/h1-4,7-10,15,26-27H,5-6,11,13-14H2/t15-/m1/s1