N-phenacylsulfanyl-N-(1H-1,2,4-triazol-5-yl)propanamide

Systemtic Name: N-phenacylsulfanyl-N-(1H-1,2,4-triazol-5-yl)propanamide Openeye Name: N-phenacylsulfanyl-N-(1H-1,2,4-triazol-5-yl)propanamide CAS Name: N-(phenacylthio)-N-(1H-1,2,4-triazol-5-yl)propanamide IUPAC Name: N-phenacylsulfanyl-N-(1H-1,2,4-triazol-5-yl)propanamide Traditional Name: N-(phenacylthio)-N-(1H-1,2,4-triazol-5-yl)propionamide Formula: C13H14N4O2S MolecularWeight: 290.34086

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)N(C1=NC=NN1)SCC(=O)C2=CC=CC=C2

Isomeric SMILES

CCC(=O)N(C1=NC=NN1)SCC(=O)C2=CC=CC=C2

InChI

InChI=1S/C13H14N4O2S/c1-2-12(19)17(13-14-9-15-16-13)20-8-11(18)10-6-4-3-5-7-10/h3-7,9H,2,8H2,1H3,(H,14,15,16)