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13097-06-8 | Benzamide, N-(4-oxo-2-thioxo-3-thiazolidinyl)-
CAS No: 13097-06-8 Catalog No: AG000V79 MDL No:MFCD00262983
Product Description
Catalog Number:
AG000V79
Chemical Name:
Benzamide, N-(4-oxo-2-thioxo-3-thiazolidinyl)-
CAS Number:
13097-06-8
Molecular Formula:
C10H8N2O2S2
Molecular Weight:
252.3127
MDL Number:
MFCD00262983
IUPAC Name:
N-(4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl)benzamide
InChI:
InChI=1S/C10H8N2O2S2/c13-8-6-16-10(15)12(8)11-9(14)7-4-2-1-3-5-7/h1-5H,6H2,(H,11,14)
InChI Key:
RUROHQISFWQEND-UHFFFAOYSA-N
SMILES:
O=C1CSC(=S)N1NC(=O)c1ccccc1
Properties
Complexity:
327
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
252.003g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
252.306g/mol
Monoisotopic Mass:
252.003g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
107A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2
Literature
| Title | Journal |
|---|---|
| Synthesis and SAR studies of 1,4-benzoxazine MenB inhibitors: novel antibacterial agents against Mycobacterium tuberculosis. | Bioorganic & medicinal chemistry letters 20101101 |
| Insecticidal and antifungal activities of aminorhodanine derivatives. | Bioscience, biotechnology, and biochemistry 19980501 |
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