3-[2-(4-chlorophenyl)sulfonylethyl]-5-(2-prop-2-enylsulfanylpyridin-3-yl)-1,3,4-oxadiazol-2-one

Systemtic Name: 3-[2-(4-chlorophenyl)sulfonylethyl]-5-(2-prop-2-enylsulfanylpyridin-3-yl)-1,3,4-oxadiazol-2-one Openeye Name: 5-(2-allylsulfanyl-3-pyridyl)-3-[2-(4-chlorophenyl)sulfonylethyl]-1,3,4-oxadiazol-2-one CAS Name: 3-[2-(4-chlorophenyl)sulfonylethyl]-5-[2-(prop-2-enylthio)-3-pyridinyl]-1,3,4-oxadiazol-2-one IUPAC Name: 3-[2-(4-chlorophenyl)sulfonylethyl]-5-(2-prop-2-enylsulfanylpyridin-3-yl)-1,3,4-oxadiazol-2-one Traditional Name: 5-[2-(allylthio)-3-pyridyl]-3-[2-(4-chlorophenyl)sulfonylethyl]-1,3,4-oxadiazol-2-one Formula: C18H16ClN3O4S2 MolecularWeight: 437.92034

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Descriptors Computed from Structure

Canonical SMILES:

C=CCSC1=C(C=CC=N1)C2=NN(C(=O)O2)CCS(=O)(=O)C3=CC=C(C=C3)Cl

Isomeric SMILES

C=CCSC1=C(C=CC=N1)C2=NN(C(=O)O2)CCS(=O)(=O)C3=CC=C(C=C3)Cl

InChI

InChI=1S/C18H16ClN3O4S2/c1-2-11-27-17-15(4-3-9-20-17)16-21-22(18(23)26-16)10-12-28(24,25)14-7-5-13(19)6-8-14/h2-9H,1,10-12H2