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

Systemtic Name: N-[5-(phenylmethylsulfanyl)-1,3,4-thiadiazol-2-yl]-2-(5-propan-2-yl-1-benzofuran-3-yl)ethanamide Openeye Name: N-(5-benzylsulfanyl-1,3,4-thiadiazol-2-yl)-2-(5-isopropylbenzofuran-3-yl)acetamide CAS Name: N-[5-(phenylmethylthio)-1,3,4-thiadiazol-2-yl]-2-(5-propan-2-yl-3-benzofuranyl)acetamide IUPAC Name: N-(5-benzylsulfanyl-1,3,4-thiadiazol-2-yl)-2-(5-propan-2-yl-1-benzofuran-3-yl)acetamide Traditional Name: N-[5-(benzylthio)-1,3,4-thiadiazol-2-yl]-2-(5-isopropylbenzofuran-3-yl)acetamide Formula: C22H21N3O2S2 MolecularWeight: 423.55104

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H21N3O2S2/c1-14(2)16-8-9-19-18(10-16)17(12-27-19)11-20(26)23-21-24-25-22(29-21)28-13-15-6-4-3-5-7-15/h3-10,12,14H,11,13H2,1-2H3,(H,23,24,26)