3,3-dimethyl-4-[2-[(3-phenyl-1,2,4-oxadiazol-5-yl)methylsulfanyl]ethanoyl]-1H-quinoxalin-2-one

Systemtic Name: 3,3-dimethyl-4-[2-[(3-phenyl-1,2,4-oxadiazol-5-yl)methylsulfanyl]ethanoyl]-1H-quinoxalin-2-one Openeye Name: 3,3-dimethyl-4-[2-[(3-phenyl-1,2,4-oxadiazol-5-yl)methylsulfanyl]acetyl]-1H-quinoxalin-2-one CAS Name: 3,3-dimethyl-4-[1-oxo-2-[(3-phenyl-1,2,4-oxadiazol-5-yl)methylthio]ethyl]-1H-quinoxalin-2-one IUPAC Name: 3,3-dimethyl-4-[2-[(3-phenyl-1,2,4-oxadiazol-5-yl)methylsulfanyl]acetyl]-1H-quinoxalin-2-one Traditional Name: 3,3-dimethyl-4-[2-[(3-phenyl-1,2,4-oxadiazol-5-yl)methylthio]acetyl]-1H-quinoxalin-2-one Formula: C21H20N4O3S MolecularWeight: 408.4735

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C(=O)NC2=CC=CC=C2N1C(=O)CSCC3=NC(=NO3)C4=CC=CC=C4)C

Isomeric SMILES

CC1(C(=O)NC2=CC=CC=C2N1C(=O)CSCC3=NC(=NO3)C4=CC=CC=C4)C

InChI

InChI=1S/C21H20N4O3S/c1-21(2)20(27)22-15-10-6-7-11-16(15)25(21)18(26)13-29-12-17-23-19(24-28-17)14-8-4-3-5-9-14/h3-11H,12-13H2,1-2H3,(H,22,27)