Name: Name:4-methyl-5-(piperidin-4-yl)-4H-1,2,4-triazole-3-thiol hydrochloride
Brand: Angene
SKU: AG01AB35
Rating: 90 (10 reviews)

4-methyl-5-(piperidin-4-yl)-4H-1,2,4-triazole-3-thiol hydrochloride

CAS No.:

1158193-23-7

Catalog Number:

AG01AB35

Molecular Formula:

C8H15ClN4S

Molecular Weight:

234.7495

Catalog Number:

AG01AB35

Chemical Name:

4-methyl-5-(piperidin-4-yl)-4H-1,2,4-triazole-3-thiol hydrochloride

CAS Number:

1158193-23-7

Molecular Formula:

C8H15ClN4S

Molecular Weight:

234.7495

MDL Number:

MFCD15200707

IUPAC Name:

4-methyl-3-piperidin-4-yl-1H-1,2,4-triazole-5-thione;hydrochloride

InChI:

InChI=1S/C8H14N4S.ClH/c1-12-7(10-11-8(12)13)6-2-4-9-5-3-6;/h6,9H,2-5H2,1H3,(H,11,13);1H

InChI Key:

DPKWYYCRBOAGTF-UHFFFAOYSA-N

SMILES:

Sc1nnc(n1C)C1CCNCC1.Cl

Complexity:

245

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

234.071g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

234.746g/mol

Monoisotopic Mass:

234.071g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

71.8A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count: