3-nitro-4-[(5-pyridin-4-yl-1,3,4-oxadiazol-2-yl)sulfanyl]benzaldehyde

Systemtic Name: 3-nitro-4-[(5-pyridin-4-yl-1,3,4-oxadiazol-2-yl)sulfanyl]benzaldehyde Openeye Name: 3-nitro-4-[[5-(4-pyridyl)-1,3,4-oxadiazol-2-yl]sulfanyl]benzaldehyde CAS Name: 3-nitro-4-[(5-pyridin-4-yl-1,3,4-oxadiazol-2-yl)thio]benzaldehyde IUPAC Name: 3-nitro-4-[(5-pyridin-4-yl-1,3,4-oxadiazol-2-yl)sulfanyl]benzaldehyde Traditional Name: 3-nitro-4-[[5-(4-pyridyl)-1,3,4-oxadiazol-2-yl]thio]benzaldehyde Formula: C14H8N4O4S MolecularWeight: 328.30272

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1C=O)[N+](=O)[O-])SC2=NN=C(O2)C3=CC=NC=C3

Isomeric SMILES

C1=CC(=C(C=C1C=O)[N+](=O)[O-])SC2=NN=C(O2)C3=CC=NC=C3

InChI

InChI=1S/C14H8N4O4S/c19-8-9-1-2-12(11(7-9)18(20)21)23-14-17-16-13(22-14)10-3-5-15-6-4-10/h1-8H