Name: Name:4-ethyl-5-(pyrazin-2-yl)-4H-1,2,4-triazole-3-thiol
Brand: Angene
SKU: AG01A0MY
Rating: 90 (10 reviews)

4-ethyl-5-(pyrazin-2-yl)-4H-1,2,4-triazole-3-thiol

CAS No.:

37545-29-2

Catalog Number:

AG01A0MY

Molecular Formula:

C8H9N5S

Molecular Weight:

207.2556

Catalog Number:

AG01A0MY

Chemical Name:

4-ethyl-5-(pyrazin-2-yl)-4H-1,2,4-triazole-3-thiol

CAS Number:

37545-29-2

Molecular Formula:

C8H9N5S

Molecular Weight:

207.2556

MDL Number:

MFCD07364220

IUPAC Name:

4-ethyl-3-pyrazin-2-yl-1H-1,2,4-triazole-5-thione

InChI:

InChI=1S/C8H9N5S/c1-2-13-7(11-12-8(13)14)6-5-9-3-4-10-6/h3-5H,2H2,1H3,(H,12,14)

InChI Key:

XXPRXVAPLPBSTB-UHFFFAOYSA-N

SMILES:

CCn1c(S)nnc1c1cnccn1

Complexity:

265

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

207.058g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

207.255g/mol

Monoisotopic Mass:

207.058g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

85.5A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

0.2