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

Systemtic Name: 4-tert-butyl-N-[5-[(4-methylsulfonylphenyl)methyl]-1,3,4-oxadiazol-2-yl]benzamide Openeye Name: 4-tert-butyl-N-[5-[(4-methylsulfonylphenyl)methyl]-1,3,4-oxadiazol-2-yl]benzamide CAS Name: 4-tert-butyl-N-[5-[(4-methylsulfonylphenyl)methyl]-1,3,4-oxadiazol-2-yl]benzamide IUPAC Name: 4-tert-butyl-N-[5-[(4-methylsulfonylphenyl)methyl]-1,3,4-oxadiazol-2-yl]benzamide Traditional Name: 4-tert-butyl-N-[5-(4-mesylbenzyl)-1,3,4-oxadiazol-2-yl]benzamide Formula: C21H23N3O4S MolecularWeight: 413.49002

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)C(=O)NC2=NN=C(O2)CC3=CC=C(C=C3)S(=O)(=O)C

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)C(=O)NC2=NN=C(O2)CC3=CC=C(C=C3)S(=O)(=O)C

InChI

InChI=1S/C21H23N3O4S/c1-21(2,3)16-9-7-15(8-10-16)19(25)22-20-24-23-18(28-20)13-14-5-11-17(12-6-14)29(4,26)27/h5-12H,13H2,1-4H3,(H,22,24,25)