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67618-11-5

67618-11-5 | Benzamide, N-[[(5-chloro-2-methoxyphenyl)amino]thioxomethyl]-

CAS No: 67618-11-5 Catalog No: AG005LKZ MDL No:

Product Description

Catalog Number:
AG005LKZ
Chemical Name:
Benzamide, N-[[(5-chloro-2-methoxyphenyl)amino]thioxomethyl]-
CAS Number:
67618-11-5
Molecular Formula:
C15H13ClN2O2S
Molecular Weight:
320.7939
IUPAC Name:
N-[(5-chloro-2-methoxyphenyl)carbamothioyl]benzamide
InChI:
InChI=1S/C15H13ClN2O2S/c1-20-13-8-7-11(16)9-12(13)17-15(21)18-14(19)10-5-3-2-4-6-10/h2-9H,1H3,(H2,17,18,19,21)
InChI Key:
DAOGSRUHYYZJHT-UHFFFAOYSA-N
SMILES:
COc1ccc(cc1NC(=S)NC(=O)c1ccccc1)Cl

Properties

Complexity:
375  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
320.039g/mol
Formal Charge:
0
Heavy Atom Count:
21  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
320.791g/mol
Monoisotopic Mass:
320.039g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
82.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.1  

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