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2651-15-2 | Benzenesulfonamide, N-[bis(methylthio)methylene]-4-methyl-
CAS No: 2651-15-2 Catalog No: AG002THV MDL No:MFCD00144854
Product Description
Catalog Number:
AG002THV
Chemical Name:
Benzenesulfonamide, N-[bis(methylthio)methylene]-4-methyl-
CAS Number:
2651-15-2
Molecular Formula:
C10H13NO2S3
Molecular Weight:
275.4107
MDL Number:
MFCD00144854
IUPAC Name:
N-[bis(methylsulfanyl)methylidene]-4-methylbenzenesulfonamide
InChI:
InChI=1S/C10H13NO2S3/c1-8-4-6-9(7-5-8)16(12,13)11-10(14-2)15-3/h4-7H,1-3H3
InChI Key:
OWIPGZGAUSIOAX-UHFFFAOYSA-N
SMILES:
CSC(=NS(=O)(=O)c1ccc(cc1)C)SC
NSC Number:
263504
Properties
Complexity:
332
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
275.011g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
275.399g/mol
Monoisotopic Mass:
275.011g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
106A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.4
Literature
| Title | Journal |
|---|---|
| Synthesis and SAR studies of 1,4-benzoxazine MenB inhibitors: novel antibacterial agents against Mycobacterium tuberculosis. | Bioorganic & medicinal chemistry letters 20101101 |
| Microsphere-based protease assays and screening application for lethal factor and factor Xa. | Cytometry. Part A : the journal of the International Society for Analytical Cytology 20060501 |
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