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

Systemtic Name: N-methyl-2-[2-[(5-phenyl-1H-1,2,4-triazol-3-yl)sulfanyl]ethanoylamino]ethanamide Openeye Name: N-methyl-2-[[2-[(5-phenyl-1H-1,2,4-triazol-3-yl)sulfanyl]acetyl]amino]acetamide CAS Name: N-methyl-2-[[1-oxo-2-[(5-phenyl-1H-1,2,4-triazol-3-yl)thio]ethyl]amino]acetamide IUPAC Name: N-methyl-2-[[2-[(5-phenyl-1H-1,2,4-triazol-3-yl)sulfanyl]acetyl]amino]acetamide Traditional Name: N-methyl-2-[[2-[(5-phenyl-1H-1,2,4-triazol-3-yl)thio]acetyl]amino]acetamide Formula: C13H15N5O2S MolecularWeight: 305.3555

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CNC(=O)CNC(=O)CSC1=NNC(=N1)C2=CC=CC=C2

Isomeric SMILES

CNC(=O)CNC(=O)CSC1=NNC(=N1)C2=CC=CC=C2

InChI

InChI=1S/C13H15N5O2S/c1-14-10(19)7-15-11(20)8-21-13-16-12(17-18-13)9-5-3-2-4-6-9/h2-6H,7-8H2,1H3,(H,14,19)(H,15,20)(H,16,17,18)