N-[5-(1-benzofuran-2-yl)-1,3,4-oxadiazol-2-yl]-4-(4-methylphenyl)sulfanyl-butanamide

Systemtic Name: N-[5-(1-benzofuran-2-yl)-1,3,4-oxadiazol-2-yl]-4-(4-methylphenyl)sulfanyl-butanamide Openeye Name: N-[5-(benzofuran-2-yl)-1,3,4-oxadiazol-2-yl]-4-(p-tolylsulfanyl)butanamide CAS Name: N-[5-(2-benzofuranyl)-1,3,4-oxadiazol-2-yl]-4-[(4-methylphenyl)thio]butanamide IUPAC Name: N-[5-(1-benzofuran-2-yl)-1,3,4-oxadiazol-2-yl]-4-(4-methylphenyl)sulfanylbutanamide Traditional Name: N-[5-(benzofuran-2-yl)-1,3,4-oxadiazol-2-yl]-4-(p-tolylthio)butyramide Formula: C21H19N3O3S MolecularWeight: 393.45886

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)SCCCC(=O)NC2=NN=C(O2)C3=CC4=CC=CC=C4O3

Isomeric SMILES

CC1=CC=C(C=C1)SCCCC(=O)NC2=NN=C(O2)C3=CC4=CC=CC=C4O3

InChI

InChI=1S/C21H19N3O3S/c1-14-8-10-16(11-9-14)28-12-4-7-19(25)22-21-24-23-20(27-21)18-13-15-5-2-3-6-17(15)26-18/h2-3,5-6,8-11,13H,4,7,12H2,1H3,(H,22,24,25)