2-[[(2S)-5-ethoxy-2-methyl-2,3-dihydro-1-benzofuran-6-yl]methylsulfanyl]-5-(2-methoxyphenyl)-1,3,4-oxadiazole

Systemtic Name: 2-[[(2S)-5-ethoxy-2-methyl-2,3-dihydro-1-benzofuran-6-yl]methylsulfanyl]-5-(2-methoxyphenyl)-1,3,4-oxadiazole Openeye Name: 2-[[(2S)-5-ethoxy-2-methyl-2,3-dihydrobenzofuran-6-yl]methylsulfanyl]-5-(2-methoxyphenyl)-1,3,4-oxadiazole CAS Name: 2-[[(2S)-5-ethoxy-2-methyl-2,3-dihydrobenzofuran-6-yl]methylthio]-5-(2-methoxyphenyl)-1,3,4-oxadiazole IUPAC Name: 2-[[(2S)-5-ethoxy-2-methyl-2,3-dihydro-1-benzofuran-6-yl]methylsulfanyl]-5-(2-methoxyphenyl)-1,3,4-oxadiazole Traditional Name: 2-[[(2S)-5-ethoxy-2-methyl-coumaran-6-yl]methylthio]-5-(2-methoxyphenyl)-1,3,4-oxadiazole Formula: C21H22N2O4S MolecularWeight: 398.47538

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C2C(=C1)CC(O2)C)CSC3=NN=C(O3)C4=CC=CC=C4OC

Isomeric SMILES

CCOC1=C(C=C2C(=C1)C[C@@H](O2)C)CSC3=NN=C(O3)C4=CC=CC=C4OC

InChI

InChI=1S/C21H22N2O4S/c1-4-25-18-10-14-9-13(2)26-19(14)11-15(18)12-28-21-23-22-20(27-21)16-7-5-6-8-17(16)24-3/h5-8,10-11,13H,4,9,12H2,1-3H3/t13-/m0/s1