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3414-97-9 | 4-(3-Mercapto-1H-1,2,4-triazol-5-yl)benzenesulfonamide
CAS No: 3414-97-9 Catalog No: AG00CZM9 MDL No:
Product Description
Catalog Number:
AG00CZM9
Chemical Name:
4-(3-Mercapto-1H-1,2,4-triazol-5-yl)benzenesulfonamide
CAS Number:
3414-97-9
IUPAC Name:
4-(5-sulfanylidene-1,2-dihydro-1,2,4-triazol-3-yl)benzenesulfonamide
InChI:
InChI=1S/C8H8N4O2S2/c9-16(13,14)6-3-1-5(2-4-6)7-10-8(15)12-11-7/h1-4H,(H2,9,13,14)(H2,10,11,12,15)
InChI Key:
YLXGKDFREFSALU-UHFFFAOYSA-N
Properties
Complexity:
418
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
256.009g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
3
Isotope Atom Count:
0
Molecular Weight:
256.298g/mol
Monoisotopic Mass:
256.009g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
137A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.4
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