2-(5-ethyl-1-benzofuran-3-yl)-N-[5-(phenylmethylsulfanyl)-1,3,4-thiadiazol-2-yl]ethanamide

Systemtic Name: 2-(5-ethyl-1-benzofuran-3-yl)-N-[5-(phenylmethylsulfanyl)-1,3,4-thiadiazol-2-yl]ethanamide Openeye Name: N-(5-benzylsulfanyl-1,3,4-thiadiazol-2-yl)-2-(5-ethylbenzofuran-3-yl)acetamide CAS Name: 2-(5-ethyl-3-benzofuranyl)-N-[5-(phenylmethylthio)-1,3,4-thiadiazol-2-yl]acetamide IUPAC Name: N-(5-benzylsulfanyl-1,3,4-thiadiazol-2-yl)-2-(5-ethyl-1-benzofuran-3-yl)acetamide Traditional Name: N-[5-(benzylthio)-1,3,4-thiadiazol-2-yl]-2-(5-ethylbenzofuran-3-yl)acetamide Formula: C21H19N3O2S2 MolecularWeight: 409.52446

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC2=C(C=C1)OC=C2CC(=O)NC3=NN=C(S3)SCC4=CC=CC=C4

Isomeric SMILES

CCC1=CC2=C(C=C1)OC=C2CC(=O)NC3=NN=C(S3)SCC4=CC=CC=C4

InChI

InChI=1S/C21H19N3O2S2/c1-2-14-8-9-18-17(10-14)16(12-26-18)11-19(25)22-20-23-24-21(28-20)27-13-15-6-4-3-5-7-15/h3-10,12H,2,11,13H2,1H3,(H,22,23,25)