6-[2-[[3-(furan-2-yl)-1,2,4-oxadiazol-5-yl]methylsulfanyl]-4-oxidanylidene-quinazolin-3-yl]hexanamide

Systemtic Name: 6-[2-[[3-(furan-2-yl)-1,2,4-oxadiazol-5-yl]methylsulfanyl]-4-oxidanylidene-quinazolin-3-yl]hexanamide Openeye Name: 6-[2-[[3-(2-furyl)-1,2,4-oxadiazol-5-yl]methylsulfanyl]-4-oxo-quinazolin-3-yl]hexanamide CAS Name: 6-[2-[[3-(2-furanyl)-1,2,4-oxadiazol-5-yl]methylthio]-4-oxo-3-quinazolinyl]hexanamide IUPAC Name: 6-[2-[[3-(furan-2-yl)-1,2,4-oxadiazol-5-yl]methylsulfanyl]-4-oxoquinazolin-3-yl]hexanamide Traditional Name: 6-[2-[[3-(2-furyl)-1,2,4-oxadiazol-5-yl]methylthio]-4-keto-quinazolin-3-yl]hexanamide Formula: C21H21N5O4S MolecularWeight: 439.48754

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)N(C(=N2)SCC3=NC(=NO3)C4=CC=CO4)CCCCCC(=O)N

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)N(C(=N2)SCC3=NC(=NO3)C4=CC=CO4)CCCCCC(=O)N

InChI

InChI=1S/C21H21N5O4S/c22-17(27)10-2-1-5-11-26-20(28)14-7-3-4-8-15(14)23-21(26)31-13-18-24-19(25-30-18)16-9-6-12-29-16/h3-4,6-9,12H,1-2,5,10-11,13H2,(H2,22,27)