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

Systemtic Name: N-propan-2-yl-4-[2-(1H-1,2,4-triazol-5-ylsulfanyl)ethanoylamino]benzamide Openeye Name: N-isopropyl-4-[[2-(1H-1,2,4-triazol-5-ylsulfanyl)acetyl]amino]benzamide CAS Name: 4-[[1-oxo-2-(1H-1,2,4-triazol-5-ylthio)ethyl]amino]-N-propan-2-ylbenzamide IUPAC Name: N-propan-2-yl-4-[[2-(1H-1,2,4-triazol-5-ylsulfanyl)acetyl]amino]benzamide Traditional Name: N-isopropyl-4-[[2-(1H-1,2,4-triazol-5-ylthio)acetyl]amino]benzamide Formula: C14H17N5O2S MolecularWeight: 319.38208

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H17N5O2S/c1-9(2)17-13(21)10-3-5-11(6-4-10)18-12(20)7-22-14-15-8-16-19-14/h3-6,8-9H,7H2,1-2H3,(H,17,21)(H,18,20)(H,15,16,19)