N-(2-methyl-6-nitro-phenyl)-2-(1H-1,2,4-triazol-5-ylsulfanyl)ethanamide

Systemtic Name: N-(2-methyl-6-nitro-phenyl)-2-(1H-1,2,4-triazol-5-ylsulfanyl)ethanamide Openeye Name: N-(2-methyl-6-nitro-phenyl)-2-(1H-1,2,4-triazol-5-ylsulfanyl)acetamide CAS Name: N-(2-methyl-6-nitrophenyl)-2-(1H-1,2,4-triazol-5-ylthio)acetamide IUPAC Name: N-(2-methyl-6-nitrophenyl)-2-(1H-1,2,4-triazol-5-ylsulfanyl)acetamide Traditional Name: N-(2-methyl-6-nitro-phenyl)-2-(1H-1,2,4-triazol-5-ylthio)acetamide Formula: C11H11N5O3S MolecularWeight: 293.30174

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)[N+](=O)[O-])NC(=O)CSC2=NC=NN2

Isomeric SMILES

CC1=C(C(=CC=C1)[N+](=O)[O-])NC(=O)CSC2=NC=NN2

InChI

InChI=1S/C11H11N5O3S/c1-7-3-2-4-8(16(18)19)10(7)14-9(17)5-20-11-12-6-13-15-11/h2-4,6H,5H2,1H3,(H,14,17)(H,12,13,15)