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

Systemtic Name: (2R)-2-[[5-(1,3-benzodioxol-5-yl)-1,3,4-oxadiazol-2-yl]sulfanyl]-1-(4-tert-butylphenyl)propan-1-one Openeye Name: (2R)-2-[[5-(1,3-benzodioxol-5-yl)-1,3,4-oxadiazol-2-yl]sulfanyl]-1-(4-tert-butylphenyl)propan-1-one CAS Name: (2R)-2-[[5-(1,3-benzodioxol-5-yl)-1,3,4-oxadiazol-2-yl]thio]-1-(4-tert-butylphenyl)-1-propanone IUPAC Name: (2R)-2-[[5-(1,3-benzodioxol-5-yl)-1,3,4-oxadiazol-2-yl]sulfanyl]-1-(4-tert-butylphenyl)propan-1-one Traditional Name: (2R)-2-[[5-(1,3-benzodioxol-5-yl)-1,3,4-oxadiazol-2-yl]thio]-1-(4-tert-butylphenyl)propan-1-one Formula: C22H22N2O4S MolecularWeight: 410.48608

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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=CC4=C(C=C3)OCO4

Isomeric SMILES

C[C@H](C(=O)C1=CC=C(C=C1)C(C)(C)C)SC2=NN=C(O2)C3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C22H22N2O4S/c1-13(19(25)14-5-8-16(9-6-14)22(2,3)4)29-21-24-23-20(28-21)15-7-10-17-18(11-15)27-12-26-17/h5-11,13H,12H2,1-4H3/t13-/m1/s1