Name: Name:1,2,4-Thiadiazole-5(2H)-thione, 3-phenyl-
Brand: Angene
SKU: AG002CWV
Rating: 90 (10 reviews)

1,2,4-Thiadiazole-5(2H)-thione, 3-phenyl-

CAS No.:

20069-34-5

Catalog Number:

AG002CWV

Molecular Formula:

C8H6N2S2

Molecular Weight:

194.2766

Catalog Number:

AG002CWV

Chemical Name:

1,2,4-Thiadiazole-5(2H)-thione, 3-phenyl-

CAS Number:

20069-34-5

Molecular Formula:

C8H6N2S2

Molecular Weight:

194.2766

MDL Number:

MFCD00086459

IUPAC Name:

3-phenyl-2H-1,2,4-thiadiazole-5-thione

InChI:

InChI=1S/C8H6N2S2/c11-8-9-7(10-12-8)6-4-2-1-3-5-6/h1-5H,(H,9,10,11)

InChI Key:

NAKQCFRTJSBUPT-UHFFFAOYSA-N

SMILES:

S=c1s[nH]c(n1)c1ccccc1

Complexity:

219

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

193.997g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

194.27g/mol

Monoisotopic Mass:

193.997g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

81.8A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

2.2