2-[(4-ethyl-5-methyl-1,2,4-triazol-3-yl)sulfanyl]-N-(3-methyl-4-nitro-phenyl)ethanamide

Systemtic Name: 2-[(4-ethyl-5-methyl-1,2,4-triazol-3-yl)sulfanyl]-N-(3-methyl-4-nitro-phenyl)ethanamide Openeye Name: 2-[(4-ethyl-5-methyl-1,2,4-triazol-3-yl)sulfanyl]-N-(3-methyl-4-nitro-phenyl)acetamide CAS Name: 2-[(4-ethyl-5-methyl-1,2,4-triazol-3-yl)thio]-N-(3-methyl-4-nitrophenyl)acetamide IUPAC Name: 2-[(4-ethyl-5-methyl-1,2,4-triazol-3-yl)sulfanyl]-N-(3-methyl-4-nitrophenyl)acetamide Traditional Name: 2-[(4-ethyl-5-methyl-1,2,4-triazol-3-yl)thio]-N-(3-methyl-4-nitro-phenyl)acetamide Formula: C14H17N5O3S MolecularWeight: 335.38148

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=NN=C1SCC(=O)NC2=CC(=C(C=C2)[N+](=O)[O-])C)C

Isomeric SMILES

CCN1C(=NN=C1SCC(=O)NC2=CC(=C(C=C2)[N+](=O)[O-])C)C

InChI

InChI=1S/C14H17N5O3S/c1-4-18-10(3)16-17-14(18)23-8-13(20)15-11-5-6-12(19(21)22)9(2)7-11/h5-7H,4,8H2,1-3H3,(H,15,20)