1-(4-tert-butylphenyl)-2-[[5-(phenylmethyl)-1,3,4-oxadiazol-2-yl]sulfanyl]ethanone

Systemtic Name: 1-(4-tert-butylphenyl)-2-[[5-(phenylmethyl)-1,3,4-oxadiazol-2-yl]sulfanyl]ethanone Openeye Name: 2-[(5-benzyl-1,3,4-oxadiazol-2-yl)sulfanyl]-1-(4-tert-butylphenyl)ethanone CAS Name: 1-(4-tert-butylphenyl)-2-[[5-(phenylmethyl)-1,3,4-oxadiazol-2-yl]thio]ethanone IUPAC Name: 2-[(5-benzyl-1,3,4-oxadiazol-2-yl)sulfanyl]-1-(4-tert-butylphenyl)ethanone Traditional Name: 2-[(5-benzyl-1,3,4-oxadiazol-2-yl)thio]-1-(4-tert-butylphenyl)ethanone Formula: C21H22N2O2S MolecularWeight: 366.47658

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)C(=O)CSC2=NN=C(O2)CC3=CC=CC=C3

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)C(=O)CSC2=NN=C(O2)CC3=CC=CC=C3

InChI

InChI=1S/C21H22N2O2S/c1-21(2,3)17-11-9-16(10-12-17)18(24)14-26-20-23-22-19(25-20)13-15-7-5-4-6-8-15/h4-12H,13-14H2,1-3H3