C16H10BrN3O2S2 structure

C16H10BrN3O2S2

4-bromo-N-[(5Z)-4-oxo-5-(pyridin-4-ylmethylidene)-2-sulfanylidene-1,3-thiazolidin-3-yl]benzamide

Also Known As: 4-bromo-N-[(5Z)-4-oxo-5-(pyridin-4-ylmethylidene)-2-thioxo-1,3-thiazolidin-3-yl]benzamide|(Z)-4-bromo-N-(4-oxo-5-(pyridin-4-ylmethylene)-2-thioxothiazolidin-3-yl)benzamide|(4-bromophenyl)-N-[4-oxo-5-(4-pyridylmethylene)-2-thioxo(1,3-thiazolidin-3-yl) ]carboxamide|4-bromo-N-[(5Z)-4-oxo-5-(pyridin-4-ylmethylidene)-2-sulfanylidene-1,3-thiazolidin-3-yl]benzamide|4-bromo-N-[4-oxo-5-(pyridin-4-ylmethylidene)-2-sulfanylidene-1,3-thiazolidin-3-yl]benzamide

CAS: 612802-83-2
Molecular Formula C16H10BrN3O2S2
Molecular Weight 418.9398 g/mol
LogP 3.3903
Topological Polar Surface Area 62.3 Ų
Hydrogen Bond Donors 1
Hydrogen Bond Acceptors 5
Rotatable Bonds 3
Exact Mass 418.9398
Monoisotopic Mass 418.9398
Heavy Atoms 24
Complexity 838.1608

Chemical Identifiers

CAS Number 612802-83-2
SMILES C1=CC(=CC=C1C(=O)NN2C(=O)/C(=C/C3=CC=NC=C3)/SC2=S)Br

Product Overview

C16H10BrN3O2S2 (CAS 612802-83-2), with molecular formula C16H10BrN3O2S2 and molecular weight 418.9398 g/mol. IUPAC: 4-bromo-N-[(5Z)-4-oxo-5-(pyridin-4-ylmethylidene)-2-sulfanylidene-1,3-thiazolidin-3-yl]benzamide.

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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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