2-[[5-(3-chloranyl-1-benzothiophen-2-yl)-1,3,4-oxadiazol-2-yl]sulfanyl]-N-cyclooctyl-ethanamide

Systemtic Name: 2-[[5-(3-chloranyl-1-benzothiophen-2-yl)-1,3,4-oxadiazol-2-yl]sulfanyl]-N-cyclooctyl-ethanamide Openeye Name: 2-[[5-(3-chlorobenzothiophen-2-yl)-1,3,4-oxadiazol-2-yl]sulfanyl]-N-cyclooctyl-acetamide CAS Name: 2-[[5-(3-chloro-1-benzothiophen-2-yl)-1,3,4-oxadiazol-2-yl]thio]-N-cyclooctylacetamide IUPAC Name: 2-[[5-(3-chloro-1-benzothiophen-2-yl)-1,3,4-oxadiazol-2-yl]sulfanyl]-N-cyclooctylacetamide Traditional Name: 2-[[5-(3-chlorobenzothiophen-2-yl)-1,3,4-oxadiazol-2-yl]thio]-N-cyclooctyl-acetamide Formula: C20H22ClN3O2S2 MolecularWeight: 435.99058

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCC(CCC1)NC(=O)CSC2=NN=C(O2)C3=C(C4=CC=CC=C4S3)Cl

Isomeric SMILES

C1CCCC(CCC1)NC(=O)CSC2=NN=C(O2)C3=C(C4=CC=CC=C4S3)Cl

InChI

InChI=1S/C20H22ClN3O2S2/c21-17-14-10-6-7-11-15(14)28-18(17)19-23-24-20(26-19)27-12-16(25)22-13-8-4-2-1-3-5-9-13/h6-7,10-11,13H,1-5,8-9,12H2,(H,22,25)