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

Systemtic Name: 4-tert-butyl-N-[[5-(phenylmethyl)sulfonyl-1,3,4-oxadiazol-2-yl]methyl]benzamide Openeye Name: N-[(5-benzylsulfonyl-1,3,4-oxadiazol-2-yl)methyl]-4-tert-butyl-benzamide CAS Name: 4-tert-butyl-N-[[5-(phenylmethyl)sulfonyl-1,3,4-oxadiazol-2-yl]methyl]benzamide IUPAC Name: N-[(5-benzylsulfonyl-1,3,4-oxadiazol-2-yl)methyl]-4-tert-butylbenzamide Traditional Name: N-[(5-benzylsulfonyl-1,3,4-oxadiazol-2-yl)methyl]-4-tert-butyl-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)NCC2=NN=C(O2)S(=O)(=O)CC3=CC=CC=C3

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)C(=O)NCC2=NN=C(O2)S(=O)(=O)CC3=CC=CC=C3

InChI

InChI=1S/C21H23N3O4S/c1-21(2,3)17-11-9-16(10-12-17)19(25)22-13-18-23-24-20(28-18)29(26,27)14-15-7-5-4-6-8-15/h4-12H,13-14H2,1-3H3,(H,22,25)