Name: Name:4-methyl-5-(morpholin-4-yl)-4H-1,2,4-triazole-3-thiol
Brand: Angene
SKU: AG019N2E
Rating: 90 (10 reviews)

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

CAS No.:

926269-71-8

Catalog Number:

AG019N2E

Molecular Formula:

C7H12N4OS

Molecular Weight:

200.2614

Catalog Number:

AG019N2E

Chemical Name:

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

CAS Number:

926269-71-8

Molecular Formula:

C7H12N4OS

Molecular Weight:

200.2614

MDL Number:

MFCD09041978

IUPAC Name:

4-methyl-3-morpholin-4-yl-1H-1,2,4-triazole-5-thione

InChI:

InChI=1S/C7H12N4OS/c1-10-6(8-9-7(10)13)11-2-4-12-5-3-11/h2-5H2,1H3,(H,9,13)

InChI Key:

YXGMOJMATVVZCN-UHFFFAOYSA-N

SMILES:

Sc1nnc(n1C)N1CCOCC1

Complexity:

249

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

200.073g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

200.26g/mol

Monoisotopic Mass:

200.073g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

72.2A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

-0.4