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Details

Stereochemistry RACEMIC
Molecular Formula C13H22N4O4S
Molecular Weight 330.403
Optical Activity ( + / - )
Defined Stereocenters 0 / 1
E/Z Centers 1
Charge 0
Stereo Comments Assumed racemic

SHOW SMILES / InChI
Structure of RANITIDINE S-OXIDE

SMILES

CNC(NCC[S+]([O-])CC1=CC=C(CN(C)C)O1)=C[N+]([O-])=O

InChI

InChIKey=SKHXRNHSZTXSLP-UHFFFAOYSA-N
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

HIDE SMILES / InChI

Molecular Formula C13H22N4O4S
Molecular Weight 330.403
Charge 0
Count
MOL RATIO 1 MOL RATIO (average)
Stereochemistry RACEMIC
Additional Stereochemistry No
Defined Stereocenters 0 / 1
E/Z Centers 1
Optical Activity ( + / - )

Approval Year

Targets

Primary TargetPharmacologyConditionPotency
Substance Class Chemical
Record UNII
TK8SB999BQ
Record Status Validated (UNII)
Record Version