AC1NK96I structure

AC1NK96I

N-(4-acetamidophenyl)-2-[[4-amino-5-(5-methyl-1H-pyrazol-3-yl)-1,2,4-triazol-3-yl]sulfanyl]acetamide

Also Known As: N-(4-acetamidophenyl)-2-((4-amino-5-(3-methyl-1H-pyrazol-5-yl)-4H-1,2,4-triazol-3-yl)thio)acetamide|N-(4-acetamidophenyl)-2-[[4-amino-5-(5-methyl-1H-pyrazol-3-yl)-1,2,4-triazol-3-yl]sulfanyl]acetamide|N-[4-(acetylamino)phenyl]-2-[4-amino-5-(3-methylpyrazol-5-yl)(1,2,4-triazol-3- ylthio)]acetamide|N-[4-(acetylamino)phenyl]-2-{[4-amino-5-(3-methyl-1H-pyrazol-5-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide

CAS: 879451-02-2
Molecular Formula C16H18N8O2S
Molecular Weight 386.12735 g/mol
LogP 1.37962
Topological Polar Surface Area 143.61 Ų
Hydrogen Bond Donors 4
Hydrogen Bond Acceptors 7
Rotatable Bonds 6
Exact Mass 386.12735
Monoisotopic Mass 386.12735
Heavy Atoms 27
Complexity 963.218

Chemical Identifiers

CAS Number 879451-02-2
SMILES CC1=CC(=NN1)C2=NN=C(N2N)SCC(=O)NC3=CC=C(C=C3)NC(=O)C

Product Overview

AC1NK96I (CAS 879451-02-2), with molecular formula C16H18N8O2S and molecular weight 386.12735 g/mol. IUPAC: N-(4-acetamidophenyl)-2-[[4-amino-5-(5-methyl-1H-pyrazol-3-yl)-1,2,4-triazol-3-yl]sulfanyl]acetamide.

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