N-(4-ethoxy-2-nitro-phenyl)-2-(2H-1,2,3-triazol-4-ylsulfanyl)ethanamide

Systemtic Name: N-(4-ethoxy-2-nitro-phenyl)-2-(2H-1,2,3-triazol-4-ylsulfanyl)ethanamide Openeye Name: N-(4-ethoxy-2-nitro-phenyl)-2-(2H-triazol-4-ylsulfanyl)acetamide CAS Name: N-(4-ethoxy-2-nitrophenyl)-2-(2H-triazol-4-ylthio)acetamide IUPAC Name: N-(4-ethoxy-2-nitrophenyl)-2-(2H-triazol-4-ylsulfanyl)acetamide Traditional Name: N-(4-ethoxy-2-nitro-phenyl)-2-(2H-triazol-4-ylthio)acetamide Formula: C12H13N5O4S MolecularWeight: 323.32772

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC(=C(C=C1)NC(=O)CSC2=NNN=C2)[N+](=O)[O-]

Isomeric SMILES

CCOC1=CC(=C(C=C1)NC(=O)CSC2=NNN=C2)[N+](=O)[O-]

InChI

InChI=1S/C12H13N5O4S/c1-2-21-8-3-4-9(10(5-8)17(19)20)14-11(18)7-22-12-6-13-16-15-12/h3-6H,2,7H2,1H3,(H,14,18)(H,13,15,16)