AC1LXSL1 structure

AC1LXSL1

(E)-3-(5-bromo-2-methoxyphenyl)-N-[[4-(4-methylphenyl)-1,3-thiazol-2-yl]carbamothioyl]prop-2-enamide

Also Known As: (E)-3-(5-bromo-2-methoxyphenyl)-N-[[4-(4-methylphenyl)-1,3-thiazol-2-yl]carbamothioyl]prop-2-enamide|(E)-3-(5-bromo-2-methoxyphenyl)-N-((4-(p-tolyl)thiazol-2-yl)carbamothioyl)acrylamide|(2E)-3-(5-bromo-2-methoxyphenyl)-N-{[(2E)-4-(4-methylphenyl)-1,3-thiazol-2(3H)-ylidene]carbamothioyl}prop-2-enamide|3-(5-bromo-2-methoxy-phenyl)-N-[[4-(4-methylphenyl)-1,3-thiazol-2-yl]thiocarbamoyl]prop-2-enamide

CAS: 690982-90-2
Molecular Formula C21H18BrN3O2S2
Molecular Weight 487.00238 g/mol
LogP 5.41602
Topological Polar Surface Area 63.25 Ų
Hydrogen Bond Donors 2
Hydrogen Bond Acceptors 5
Rotatable Bonds 5
Exact Mass 487.00238
Monoisotopic Mass 487.00238
Heavy Atoms 29
Complexity 1062.0431

Chemical Identifiers

CAS Number 690982-90-2
SMILES CC1=CC=C(C=C1)C2=CSC(=N2)NC(=S)NC(=O)/C=C/C3=C(C=CC(=C3)Br)OC

Product Overview

AC1LXSL1 (CAS 690982-90-2), with molecular formula C21H18BrN3O2S2 and molecular weight 487.00238 g/mol. IUPAC: (E)-3-(5-bromo-2-methoxyphenyl)-N-[[4-(4-methylphenyl)-1,3-thiazol-2-yl]carbamothioyl]prop-2-enamide.

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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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