Name: Name:2-chloro-N-[1-(1,1-dioxo-1lambda6-thiolan-3-yl)-3-methyl-1H-pyrazol-5-yl]acetamide
Brand: Angene
SKU: AG019PPR
Rating: 90 (10 reviews)

2-chloro-N-[1-(1,1-dioxo-1lambda6-thiolan-3-yl)-3-methyl-1H-pyrazol-5-yl]acetamide

CAS No.:

956769-05-4

Catalog Number:

AG019PPR

Molecular Formula:

C10H14ClN3O3S

Molecular Weight:

291.7545

Catalog Number:

AG019PPR

Chemical Name:

2-chloro-N-[1-(1,1-dioxo-1lambda6-thiolan-3-yl)-3-methyl-1H-pyrazol-5-yl]acetamide

CAS Number:

956769-05-4

Molecular Formula:

C10H14ClN3O3S

Molecular Weight:

291.7545

MDL Number:

MFCD09383879

IUPAC Name:

2-chloro-N-[2-(1,1-dioxothiolan-3-yl)-5-methylpyrazol-3-yl]acetamide

InChI:

InChI=1S/C10H14ClN3O3S/c1-7-4-9(12-10(15)5-11)14(13-7)8-2-3-18(16,17)6-8/h4,8H,2-3,5-6H2,1H3,(H,12,15)

InChI Key:

WITNVVASPPNSHW-UHFFFAOYSA-N

SMILES:

ClCC(=O)Nc1cc(nn1C1CCS(=O)(=O)C1)C

Complexity:

423

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

291.044g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

291.75g/mol

Monoisotopic Mass:

291.044g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

89.4A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

0.2