N-(3,3-dimethyl-2-oxidanylidene-butyl)-2-[[5-(furan-2-yl)-1,2-oxazol-3-yl]methylsulfanyl]benzamide

Systemtic Name: N-(3,3-dimethyl-2-oxidanylidene-butyl)-2-[[5-(furan-2-yl)-1,2-oxazol-3-yl]methylsulfanyl]benzamide Openeye Name: N-(3,3-dimethyl-2-oxo-butyl)-2-[[5-(2-furyl)isoxazol-3-yl]methylsulfanyl]benzamide CAS Name: N-(3,3-dimethyl-2-oxobutyl)-2-[[5-(2-furanyl)-3-isoxazolyl]methylthio]benzamide IUPAC Name: N-(3,3-dimethyl-2-oxobutyl)-2-[[5-(furan-2-yl)-1,2-oxazol-3-yl]methylsulfanyl]benzamide Traditional Name: 2-[[5-(2-furyl)isoxazol-3-yl]methylthio]-N-(2-keto-3,3-dimethyl-butyl)benzamide Formula: C21H22N2O4S MolecularWeight: 398.47538

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(=O)CNC(=O)C1=CC=CC=C1SCC2=NOC(=C2)C3=CC=CO3

Isomeric SMILES

CC(C)(C)C(=O)CNC(=O)C1=CC=CC=C1SCC2=NOC(=C2)C3=CC=CO3

InChI

InChI=1S/C21H22N2O4S/c1-21(2,3)19(24)12-22-20(25)15-7-4-5-9-18(15)28-13-14-11-17(27-23-14)16-8-6-10-26-16/h4-11H,12-13H2,1-3H3,(H,22,25)