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84445-90-9

84445-90-9 | Acetamide, N-(2,3-dihydro-2-thioxo-1H-benzimidazol-5-yl)-

CAS No: 84445-90-9 Catalog No: AG0055NO MDL No:

Product Description

Catalog Number:
AG0055NO
Chemical Name:
Acetamide, N-(2,3-dihydro-2-thioxo-1H-benzimidazol-5-yl)-
CAS Number:
84445-90-9
Molecular Formula:
C9H9N3OS
Molecular Weight:
207.2523
IUPAC Name:
N-(2-sulfanylidene-1,3-dihydrobenzimidazol-5-yl)acetamide
InChI:
InChI=1S/C9H9N3OS/c1-5(13)10-6-2-3-7-8(4-6)12-9(14)11-7/h2-4H,1H3,(H,10,13)(H2,11,12,14)
InChI Key:
OKXUBGULDQECIU-UHFFFAOYSA-N
SMILES:
CC(=O)Nc1ccc2c(c1)[nH]c(=S)[nH]2

Properties

Complexity:
269  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
207.047g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
3  
Isotope Atom Count:
0
Molecular Weight:
207.251g/mol
Monoisotopic Mass:
207.047g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
85.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.3  

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