Name: Name:Ranitidine S-Oxide
Brand: Angene
SKU: AG008PWN
Rating: 90 (10 reviews)

Ranitidine S-Oxide

CAS No.:

73851-70-4

Catalog Number:

AG008PWN

Molecular Formula:

C13H22N4O4S

Molecular Weight:

330.4032

Catalog Number:

AG008PWN

Chemical Name:

Ranitidine S-Oxide

CAS Number:

73851-70-4

Molecular Formula:

C13H22N4O4S

Molecular Weight:

330.4032

MDL Number:

MFCD08063699

IUPAC Name:

(E)-1-N'-[2-[[5-[(dimethylamino)methyl]furan-2-yl]methylsulfinyl]ethyl]-1-N-methyl-2-nitroethene-1,1-diamine

InChI:

InChI=1S/C13H22N4O4S/c1-14-13(9-17(18)19)15-6-7-22(20)10-12-5-4-11(21-12)8-16(2)3/h4-5,9,14-15H,6-8,10H2,1-3H3/b13-9+

InChI Key:

SKHXRNHSZTXSLP-UKTHLTGXSA-N

SMILES:

CNC(=C[N+](=O)[O-])NCCS(=O)Cc1ccc(o1)CN(C)C

Complexity:

411

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

330.136g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

330.403g/mol

Monoisotopic Mass:

330.136g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

123A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

0.2