(2S)-2-[2-(furan-2-yl)quinazolin-4-yl]sulfanyl-N-(2-oxidanylidene-1,3-dihydrobenzimidazol-5-yl)propanamide

Systemtic Name: (2S)-2-[2-(furan-2-yl)quinazolin-4-yl]sulfanyl-N-(2-oxidanylidene-1,3-dihydrobenzimidazol-5-yl)propanamide Openeye Name: (2S)-2-[2-(2-furyl)quinazolin-4-yl]sulfanyl-N-(2-oxo-1,3-dihydrobenzimidazol-5-yl)propanamide CAS Name: (2S)-2-[[2-(2-furanyl)-4-quinazolinyl]thio]-N-(2-oxo-1,3-dihydrobenzimidazol-5-yl)propanamide IUPAC Name: (2S)-2-[2-(furan-2-yl)quinazolin-4-yl]sulfanyl-N-(2-oxo-1,3-dihydrobenzimidazol-5-yl)propanamide Traditional Name: (2S)-2-[[2-(2-furyl)quinazolin-4-yl]thio]-N-(2-keto-1,3-dihydrobenzimidazol-5-yl)propionamide Formula: C22H17N5O3S MolecularWeight: 431.46708

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC2=C(C=C1)NC(=O)N2)SC3=NC(=NC4=CC=CC=C43)C5=CC=CO5

Isomeric SMILES

C[C@@H](C(=O)NC1=CC2=C(C=C1)NC(=O)N2)SC3=NC(=NC4=CC=CC=C43)C5=CC=CO5

InChI

InChI=1S/C22H17N5O3S/c1-12(20(28)23-13-8-9-16-17(11-13)26-22(29)25-16)31-21-14-5-2-3-6-15(14)24-19(27-21)18-7-4-10-30-18/h2-12H,1H3,(H,23,28)(H2,25,26,29)/t12-/m0/s1