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

Systemtic Name: 5-ethyl-3-methyl-N-[5-(phenylmethylsulfanyl)-1,3,4-thiadiazol-2-yl]-1-benzofuran-2-carboxamide Openeye Name: N-(5-benzylsulfanyl-1,3,4-thiadiazol-2-yl)-5-ethyl-3-methyl-benzofuran-2-carboxamide CAS Name: 5-ethyl-3-methyl-N-[5-(phenylmethylthio)-1,3,4-thiadiazol-2-yl]-2-benzofurancarboxamide IUPAC Name: N-(5-benzylsulfanyl-1,3,4-thiadiazol-2-yl)-5-ethyl-3-methyl-1-benzofuran-2-carboxamide Traditional Name: N-[5-(benzylthio)-1,3,4-thiadiazol-2-yl]-5-ethyl-3-methyl-coumarilamide Formula: C21H19N3O2S2 MolecularWeight: 409.52446

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC2=C(C=C1)OC(=C2C)C(=O)NC3=NN=C(S3)SCC4=CC=CC=C4

Isomeric SMILES

CCC1=CC2=C(C=C1)OC(=C2C)C(=O)NC3=NN=C(S3)SCC4=CC=CC=C4

InChI

InChI=1S/C21H19N3O2S2/c1-3-14-9-10-17-16(11-14)13(2)18(26-17)19(25)22-20-23-24-21(28-20)27-12-15-7-5-4-6-8-15/h4-11H,3,12H2,1-2H3,(H,22,23,25)