2-[(5-azanyl-1,3,4-thiadiazol-2-yl)sulfanyl]-1-(1,3-benzodioxol-5-yl)ethanone

Systemtic Name: 2-[(5-azanyl-1,3,4-thiadiazol-2-yl)sulfanyl]-1-(1,3-benzodioxol-5-yl)ethanone Openeye Name: 2-[(5-amino-1,3,4-thiadiazol-2-yl)sulfanyl]-1-(1,3-benzodioxol-5-yl)ethanone CAS Name: 2-[(5-amino-1,3,4-thiadiazol-2-yl)thio]-1-(1,3-benzodioxol-5-yl)ethanone IUPAC Name: 2-[(5-amino-1,3,4-thiadiazol-2-yl)sulfanyl]-1-(1,3-benzodioxol-5-yl)ethanone Traditional Name: 2-[(5-amino-1,3,4-thiadiazol-2-yl)thio]-1-(1,3-benzodioxol-5-yl)ethanone Formula: C11H9N3O3S2 MolecularWeight: 295.33746

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)C(=O)CSC3=NN=C(S3)N

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)C(=O)CSC3=NN=C(S3)N

InChI

InChI=1S/C11H9N3O3S2/c12-10-13-14-11(19-10)18-4-7(15)6-1-2-8-9(3-6)17-5-16-8/h1-3H,4-5H2,(H2,12,13)