AC1OC0TQ structure

AC1OC0TQ

1-(4-amino-1,2,5-oxadiazol-3-yl)-N-[(E)-furan-2-ylmethylideneamino]-5-[(4-methylphenyl)sulfanylmethyl]triazole-4-carboxamide

Also Known As: (E)-1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-(furan-2-ylmethylene)-5-((p-tolylthio)methyl)-1H-1,2,3-triazole-4-carbohydrazide|1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-[(E)-furan-2-ylmethylidene]-5-{[(4-methylphenyl)sulfanyl]methyl}-1H-1,2,3-triazole-4-carbohydrazide|1-(4-amino-1,2,5-oxadiazol-3-yl)-N-[(E)-furan-2-ylmethylideneamino]-5-[(4-methylphenyl)sulfanylmethyl]triazole-4-carboxamide

CAS: 849005-49-8
Molecular Formula C18H16N8O3S
Molecular Weight 424.1066 g/mol
LogP 2.19012
Topological Polar Surface Area 150.25 Ų
Hydrogen Bond Donors 2
Hydrogen Bond Acceptors 10
Rotatable Bonds 7
Exact Mass 424.1066
Monoisotopic Mass 424.1066
Heavy Atoms 30
Complexity 1164.7478

Chemical Identifiers

CAS Number 849005-49-8
SMILES CC1=CC=C(C=C1)SCC2=C(N=NN2C3=NON=C3N)C(=O)N/N=C/C4=CC=CO4

Product Overview

AC1OC0TQ (CAS 849005-49-8), with molecular formula C18H16N8O3S and molecular weight 424.1066 g/mol. IUPAC: 1-(4-amino-1,2,5-oxadiazol-3-yl)-N-[(E)-furan-2-ylmethylideneamino]-5-[(4-methylphenyl)sulfanylmethyl]triazole-4-carboxamide.

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Safety Data Sheet (MSDS / SDS) View the Laboratory Chemical Safety Summary (LCSS) on PubChem — includes GHS classifications, hazard statements, first aid measures, and handling precautions.
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