AC1LUHSQ structure

AC1LUHSQ

(E)-2-[4-(3,4-dimethoxyphenyl)-1,3-thiazol-2-yl]-3-(3-nitroanilino)prop-2-enenitrile

Also Known As: (E)-2-(4-(3,4-dimethoxyphenyl)thiazol-2-yl)-3-((3-nitrophenyl)amino)acrylonitrile|(E)-2-[4-(3,4-dimethoxyphenyl)-1,3-thiazol-2-yl]-3-(3-nitroanilino)prop-2-enenitrile|(2E)-2-[4-(3,4-dimethoxyphenyl)-1,3-thiazol-2-yl]-3-[(3-nitrophenyl)amino]prop-2-enenitrile

CAS: 373376-15-9
Molecular Formula C20H16N4O4S
Molecular Weight 408.08923 g/mol
LogP 4.71208
Topological Polar Surface Area 110.31 Ų
Hydrogen Bond Donors 1
Hydrogen Bond Acceptors 8
Rotatable Bonds 7
Exact Mass 408.08923
Monoisotopic Mass 408.08923
Heavy Atoms 29
Complexity 1117.6642

Chemical Identifiers

CAS Number 373376-15-9
SMILES COC1=C(C=C(C=C1)C2=CSC(=N2)/C(=C/NC3=CC(=CC=C3)[N+](=O)[O-])/C#N)OC

Product Overview

AC1LUHSQ (CAS 373376-15-9), with molecular formula C20H16N4O4S and molecular weight 408.08923 g/mol. IUPAC: (E)-2-[4-(3,4-dimethoxyphenyl)-1,3-thiazol-2-yl]-3-(3-nitroanilino)prop-2-enenitrile.

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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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