(2S)-1-(4-tert-butylphenyl)-2-[(5-pyridin-4-yl-1,3,4-oxadiazol-2-yl)sulfanyl]propan-1-one

Systemtic Name: (2S)-1-(4-tert-butylphenyl)-2-[(5-pyridin-4-yl-1,3,4-oxadiazol-2-yl)sulfanyl]propan-1-one Openeye Name: (2S)-1-(4-tert-butylphenyl)-2-[[5-(4-pyridyl)-1,3,4-oxadiazol-2-yl]sulfanyl]propan-1-one CAS Name: (2S)-1-(4-tert-butylphenyl)-2-[(5-pyridin-4-yl-1,3,4-oxadiazol-2-yl)thio]-1-propanone IUPAC Name: (2S)-1-(4-tert-butylphenyl)-2-[(5-pyridin-4-yl-1,3,4-oxadiazol-2-yl)sulfanyl]propan-1-one Traditional Name: (2S)-1-(4-tert-butylphenyl)-2-[[5-(4-pyridyl)-1,3,4-oxadiazol-2-yl]thio]propan-1-one Formula: C20H21N3O2S MolecularWeight: 367.46464

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)C1=CC=C(C=C1)C(C)(C)C)SC2=NN=C(O2)C3=CC=NC=C3

Isomeric SMILES

C[C@@H](C(=O)C1=CC=C(C=C1)C(C)(C)C)SC2=NN=C(O2)C3=CC=NC=C3

InChI

InChI=1S/C20H21N3O2S/c1-13(17(24)14-5-7-16(8-6-14)20(2,3)4)26-19-23-22-18(25-19)15-9-11-21-12-10-15/h5-13H,1-4H3/t13-/m0/s1