Name: Name:sodium 2-[(1-benzyl-1H-imidazol-2-yl)sulfanyl]acetate
Brand: Angene
SKU: AG01B9KO
Rating: 90 (10 reviews)

sodium 2-[(1-benzyl-1H-imidazol-2-yl)sulfanyl]acetate

CAS No.:

1803598-72-2

Catalog Number:

AG01B9KO

Molecular Formula:

C12H11N2NaO2S

Molecular Weight:

270.2827

Catalog Number:

AG01B9KO

Chemical Name:

sodium 2-[(1-benzyl-1H-imidazol-2-yl)sulfanyl]acetate

CAS Number:

1803598-72-2

Molecular Formula:

C12H11N2NaO2S

Molecular Weight:

270.2827

MDL Number:

MFCD28383903

IUPAC Name:

sodium;2-(1-benzylimidazol-2-yl)sulfanylacetate

InChI:

InChI=1S/C12H12N2O2S.Na/c15-11(16)9-17-12-13-6-7-14(12)8-10-4-2-1-3-5-10;/h1-7H,8-9H2,(H,15,16);/q;+1/p-1

InChI Key:

PMGCLABMQPQWGE-UHFFFAOYSA-M

SMILES:

[O-]C(=O)CSc1nccn1Cc1ccccc1.[Na+]

Complexity:

263

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

270.044g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

270.282g/mol

Monoisotopic Mass:

270.044g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

83.2A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count: