3-(4-ethylphenyl)-5-[(5-pyrrolidin-1-ylsulfonylpyridin-2-yl)sulfanylmethyl]-1,2,4-oxadiazole

Systemtic Name: 3-(4-ethylphenyl)-5-[(5-pyrrolidin-1-ylsulfonylpyridin-2-yl)sulfanylmethyl]-1,2,4-oxadiazole Openeye Name: 3-(4-ethylphenyl)-5-[(5-pyrrolidin-1-ylsulfonyl-2-pyridyl)sulfanylmethyl]-1,2,4-oxadiazole CAS Name: 3-(4-ethylphenyl)-5-[[[5-(1-pyrrolidinylsulfonyl)-2-pyridinyl]thio]methyl]-1,2,4-oxadiazole IUPAC Name: 3-(4-ethylphenyl)-5-[(5-pyrrolidin-1-ylsulfonylpyridin-2-yl)sulfanylmethyl]-1,2,4-oxadiazole Traditional Name: 3-(4-ethylphenyl)-5-[[(5-pyrrolidinosulfonyl-2-pyridyl)thio]methyl]-1,2,4-oxadiazole Formula: C20H22N4O3S2 MolecularWeight: 430.54368

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)C2=NOC(=N2)CSC3=NC=C(C=C3)S(=O)(=O)N4CCCC4

Isomeric SMILES

CCC1=CC=C(C=C1)C2=NOC(=N2)CSC3=NC=C(C=C3)S(=O)(=O)N4CCCC4

InChI

InChI=1S/C20H22N4O3S2/c1-2-15-5-7-16(8-6-15)20-22-18(27-23-20)14-28-19-10-9-17(13-21-19)29(25,26)24-11-3-4-12-24/h5-10,13H,2-4,11-12,14H2,1H3