2-[(4-chlorophenyl)methylsulfanyl]-5-(4-pyrrolidin-1-ylsulfonylphenyl)-1,3,4-oxadiazole

Systemtic Name: 2-[(4-chlorophenyl)methylsulfanyl]-5-(4-pyrrolidin-1-ylsulfonylphenyl)-1,3,4-oxadiazole Openeye Name: 2-[(4-chlorophenyl)methylsulfanyl]-5-(4-pyrrolidin-1-ylsulfonylphenyl)-1,3,4-oxadiazole CAS Name: 2-[(4-chlorophenyl)methylthio]-5-[4-(1-pyrrolidinylsulfonyl)phenyl]-1,3,4-oxadiazole IUPAC Name: 2-[(4-chlorophenyl)methylsulfanyl]-5-(4-pyrrolidin-1-ylsulfonylphenyl)-1,3,4-oxadiazole Traditional Name: 2-[(4-chlorobenzyl)thio]-5-(4-pyrrolidinosulfonylphenyl)-1,3,4-oxadiazole Formula: C19H18ClN3O3S2 MolecularWeight: 435.94752

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)S(=O)(=O)C2=CC=C(C=C2)C3=NN=C(O3)SCC4=CC=C(C=C4)Cl

Isomeric SMILES

C1CCN(C1)S(=O)(=O)C2=CC=C(C=C2)C3=NN=C(O3)SCC4=CC=C(C=C4)Cl

InChI

InChI=1S/C19H18ClN3O3S2/c20-16-7-3-14(4-8-16)13-27-19-22-21-18(26-19)15-5-9-17(10-6-15)28(24,25)23-11-1-2-12-23/h3-10H,1-2,11-13H2