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

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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