N-[5-(phenylmethylsulfanyl)-1,3,4-thiadiazol-2-yl]dibenzofuran-2-carboxamide

Systemtic Name: N-[5-(phenylmethylsulfanyl)-1,3,4-thiadiazol-2-yl]dibenzofuran-2-carboxamide Openeye Name: N-(5-benzylsulfanyl-1,3,4-thiadiazol-2-yl)dibenzofuran-2-carboxamide CAS Name: N-[5-(phenylmethylthio)-1,3,4-thiadiazol-2-yl]-2-dibenzofurancarboxamide IUPAC Name: N-(5-benzylsulfanyl-1,3,4-thiadiazol-2-yl)dibenzofuran-2-carboxamide Traditional Name: N-[5-(benzylthio)-1,3,4-thiadiazol-2-yl]dibenzofuran-2-carboxamide Formula: C22H15N3O2S2 MolecularWeight: 417.5034

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CSC2=NN=C(S2)NC(=O)C3=CC4=C(C=C3)OC5=CC=CC=C54

Isomeric SMILES

C1=CC=C(C=C1)CSC2=NN=C(S2)NC(=O)C3=CC4=C(C=C3)OC5=CC=CC=C54

InChI

InChI=1S/C22H15N3O2S2/c26-20(15-10-11-19-17(12-15)16-8-4-5-9-18(16)27-19)23-21-24-25-22(29-21)28-13-14-6-2-1-3-7-14/h1-12H,13H2,(H,23,24,26)