AC1OBTPI structure

AC1OBTPI

N-[(E)-[4-(diethylamino)phenyl]methylideneamino]-2-[[4-(4-methoxyphenyl)-5-(4-methylphenyl)-1,2,4-triazol-3-yl]sulfanyl]acetamide

Also Known As: N'-{(E)-[4-(diethylamino)phenyl]methylidene}-2-{[4-(4-methoxyphenyl)-5-(4-methylphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetohydrazide|(E)-N'-(4-(diethylamino)benzylidene)-2-((4-(4-methoxyphenyl)-5-(p-tolyl)-4H-1,2,4-triazol-3-yl)thio)acetohydrazide|N-[(E)-[4-(diethylamino)phenyl]methylideneamino]-2-[[4-(4-methoxyphenyl)-5-(4-methylphenyl)-1,2,4-triazol-3-yl]sulfanyl]acetamide|N-{(1E)-2-[4-(diethylamino)phenyl]-1-azavinyl}-2-[4-(4-methoxyphenyl)-5-(4-met hylphenyl)(1,2,4-triazol-3-ylthio)]acetamide

CAS: 406465-52-9
Molecular Formula C29H32N6O2S
Molecular Weight 528.2308 g/mol
LogP 5.33992
Topological Polar Surface Area 84.64 Ų
Hydrogen Bond Donors 1
Hydrogen Bond Acceptors 7
Rotatable Bonds 11
Exact Mass 528.2308
Monoisotopic Mass 528.2308
Heavy Atoms 38
Complexity 1361.961

Chemical Identifiers

CAS Number 406465-52-9
SMILES CCN(CC)C1=CC=C(C=C1)/C=N/NC(=O)CSC2=NN=C(N2C3=CC=C(C=C3)OC)C4=CC=C(C=C4)C

Product Overview

AC1OBTPI (CAS 406465-52-9), with molecular formula C29H32N6O2S and molecular weight 528.2308 g/mol. IUPAC: N-[(E)-[4-(diethylamino)phenyl]methylideneamino]-2-[[4-(4-methoxyphenyl)-5-(4-methylphenyl)-1,2,4-triazol-3-yl]sulfanyl]acetamide.

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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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