N-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-[(3-thiophen-2-yl-1,2,4-oxadiazol-5-yl)methylsulfanyl]propanamide

Systemtic Name: N-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-[(3-thiophen-2-yl-1,2,4-oxadiazol-5-yl)methylsulfanyl]propanamide Openeye Name: N-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-[[3-(2-thienyl)-1,2,4-oxadiazol-5-yl]methylsulfanyl]propanamide CAS Name: N-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-[(3-thiophen-2-yl-1,2,4-oxadiazol-5-yl)methylthio]propanamide IUPAC Name: N-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-[(3-thiophen-2-yl-1,2,4-oxadiazol-5-yl)methylsulfanyl]propanamide Traditional Name: N-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-[[3-(2-thienyl)-1,2,4-oxadiazol-5-yl]methylthio]propionamide Formula: C18H17N3O4S2 MolecularWeight: 403.47528

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC2=C(C=C1)OCCO2)SCC3=NC(=NO3)C4=CC=CS4

Isomeric SMILES

CC(C(=O)NC1=CC2=C(C=C1)OCCO2)SCC3=NC(=NO3)C4=CC=CS4

InChI

InChI=1S/C18H17N3O4S2/c1-11(27-10-16-20-17(21-25-16)15-3-2-8-26-15)18(22)19-12-4-5-13-14(9-12)24-7-6-23-13/h2-5,8-9,11H,6-7,10H2,1H3,(H,19,22)