4-ethoxy-N-(5-ethyl-1,3,4-thiadiazol-2-yl)-3-nitro-benzamide

Systemtic Name: 4-ethoxy-N-(5-ethyl-1,3,4-thiadiazol-2-yl)-3-nitro-benzamide Openeye Name: 4-ethoxy-N-(5-ethyl-1,3,4-thiadiazol-2-yl)-3-nitro-benzamide CAS Name: 4-ethoxy-N-(5-ethyl-1,3,4-thiadiazol-2-yl)-3-nitrobenzamide IUPAC Name: 4-ethoxy-N-(5-ethyl-1,3,4-thiadiazol-2-yl)-3-nitrobenzamide Traditional Name: 4-ethoxy-N-(5-ethyl-1,3,4-thiadiazol-2-yl)-3-nitro-benzamide Formula: C13H14N4O4S MolecularWeight: 322.33966

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=NN=C(S1)NC(=O)C2=CC(=C(C=C2)OCC)[N+](=O)[O-]

Isomeric SMILES

CCC1=NN=C(S1)NC(=O)C2=CC(=C(C=C2)OCC)[N+](=O)[O-]

InChI

InChI=1S/C13H14N4O4S/c1-3-11-15-16-13(22-11)14-12(18)8-5-6-10(21-4-2)9(7-8)17(19)20/h5-7H,3-4H2,1-2H3,(H,14,16,18)