N,N-diethyl-4-[2-(1H-1,2,4-triazol-5-ylsulfanyl)ethanoylamino]benzamide

Systemtic Name: N,N-diethyl-4-[2-(1H-1,2,4-triazol-5-ylsulfanyl)ethanoylamino]benzamide Openeye Name: N,N-diethyl-4-[[2-(1H-1,2,4-triazol-5-ylsulfanyl)acetyl]amino]benzamide CAS Name: N,N-diethyl-4-[[1-oxo-2-(1H-1,2,4-triazol-5-ylthio)ethyl]amino]benzamide IUPAC Name: N,N-diethyl-4-[[2-(1H-1,2,4-triazol-5-ylsulfanyl)acetyl]amino]benzamide Traditional Name: N,N-diethyl-4-[[2-(1H-1,2,4-triazol-5-ylthio)acetyl]amino]benzamide Formula: C15H19N5O2S MolecularWeight: 333.40866

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C(=O)C1=CC=C(C=C1)NC(=O)CSC2=NC=NN2

Isomeric SMILES

CCN(CC)C(=O)C1=CC=C(C=C1)NC(=O)CSC2=NC=NN2

InChI

InChI=1S/C15H19N5O2S/c1-3-20(4-2)14(22)11-5-7-12(8-6-11)18-13(21)9-23-15-16-10-17-19-15/h5-8,10H,3-4,9H2,1-2H3,(H,18,21)(H,16,17,19)