Name: Name:2-methoxy-2-(1-methyl-1H-pyrazol-4-yl)ethanethioamide
Brand: Angene
SKU: AG01EIPC
Rating: 90 (10 reviews)

2-methoxy-2-(1-methyl-1H-pyrazol-4-yl)ethanethioamide

CAS No.:

2138517-44-7

Catalog Number:

AG01EIPC

Molecular Formula:

C7H11N3OS

Molecular Weight:

185.2467

Catalog Number:

AG01EIPC

Chemical Name:

2-methoxy-2-(1-methyl-1H-pyrazol-4-yl)ethanethioamide

CAS Number:

2138517-44-7

Molecular Formula:

C7H11N3OS

Molecular Weight:

185.2467

MDL Number:

MFCD31615484

IUPAC Name:

2-methoxy-2-(1-methylpyrazol-4-yl)ethanethioamide

InChI:

InChI=1S/C7H11N3OS/c1-10-4-5(3-9-10)6(11-2)7(8)12/h3-4,6H,1-2H3,(H2,8,12)

InChI Key:

JBYZBEPTQQYOCC-UHFFFAOYSA-N

SMILES:

COC(c1cnn(c1)C)C(=S)N

Complexity:

176

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

185.062g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

185.245g/mol

Monoisotopic Mass:

185.062g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

85.2A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

-0.4