3-nitro-N-[5-(2-thiophen-2-ylethylamino)-1,3,4-thiadiazol-2-yl]benzamide

Systemtic Name: 3-nitro-N-[5-(2-thiophen-2-ylethylamino)-1,3,4-thiadiazol-2-yl]benzamide Openeye Name: 3-nitro-N-[5-[2-(2-thienyl)ethylamino]-1,3,4-thiadiazol-2-yl]benzamide CAS Name: 3-nitro-N-[5-(2-thiophen-2-ylethylamino)-1,3,4-thiadiazol-2-yl]benzamide IUPAC Name: 3-nitro-N-[5-(2-thiophen-2-ylethylamino)-1,3,4-thiadiazol-2-yl]benzamide Traditional Name: 3-nitro-N-[5-[2-(2-thienyl)ethylamino]-1,3,4-thiadiazol-2-yl]benzamide Formula: C15H13N5O3S2 MolecularWeight: 375.42542

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)[N+](=O)[O-])C(=O)NC2=NN=C(S2)NCCC3=CC=CS3

Isomeric SMILES

C1=CC(=CC(=C1)[N+](=O)[O-])C(=O)NC2=NN=C(S2)NCCC3=CC=CS3

InChI

InChI=1S/C15H13N5O3S2/c21-13(10-3-1-4-11(9-10)20(22)23)17-15-19-18-14(25-15)16-7-6-12-5-2-8-24-12/h1-5,8-9H,6-7H2,(H,16,18)(H,17,19,21)