4-tert-butyl-N-[[5-(2-oxidanylidenepropylsulfanyl)-1,3,4-oxadiazol-2-yl]methyl]benzamide

Systemtic Name: 4-tert-butyl-N-[[5-(2-oxidanylidenepropylsulfanyl)-1,3,4-oxadiazol-2-yl]methyl]benzamide Openeye Name: N-[(5-acetonylsulfanyl-1,3,4-oxadiazol-2-yl)methyl]-4-tert-butyl-benzamide CAS Name: 4-tert-butyl-N-[[5-(2-oxopropylthio)-1,3,4-oxadiazol-2-yl]methyl]benzamide IUPAC Name: 4-tert-butyl-N-[[5-(2-oxopropylsulfanyl)-1,3,4-oxadiazol-2-yl]methyl]benzamide Traditional Name: N-[[5-(acetonylthio)-1,3,4-oxadiazol-2-yl]methyl]-4-tert-butyl-benzamide Formula: C17H21N3O3S MolecularWeight: 347.43194

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)CSC1=NN=C(O1)CNC(=O)C2=CC=C(C=C2)C(C)(C)C

Isomeric SMILES

CC(=O)CSC1=NN=C(O1)CNC(=O)C2=CC=C(C=C2)C(C)(C)C

InChI

InChI=1S/C17H21N3O3S/c1-11(21)10-24-16-20-19-14(23-16)9-18-15(22)12-5-7-13(8-6-12)17(2,3)4/h5-8H,9-10H2,1-4H3,(H,18,22)