U.S. Department of Health & Human Services Divider Arrow National Institutes of Health Divider Arrow NCATS

Details

Stereochemistry ABSOLUTE
Molecular Formula C10H16N6OS
Molecular Weight 268.339
Optical Activity ( + )
Defined Stereocenters 1 / 1
E/Z Centers 1
Charge 0

SHOW SMILES / InChI
Structure of CIMETIDINE SULFOXIDE, (R)-

SMILES

CNC(NCC[S@@+]([O-])CC1=C(C)NC=N1)=NC#N

InChI

InChIKey=HOJLJLYVNQFCRE-GOSISDBHSA-N
InChI=1S/C10H16N6OS/c1-8-9(16-7-15-8)5-18(17)4-3-13-10(12-2)14-6-11/h7H,3-5H2,1-2H3,(H,15,16)(H2,12,13,14)/t18-/m1/s1

HIDE SMILES / InChI

Approval Year

Unknown
139594
Name Type Language
CIMETIDINE SULFOXIDE, (R)-
Common Name English
GUANIDINE, N-CYANO-N'-METHYL-N''-(2-((R)-((4-METHYL-1H-IMIDAZOL-5-YL)METHYL)SULFINYL)ETHYL)-
Systematic Name English
N-CYANO-N'-METHYL-N''-(2-((R)-((4-METHYL-1H-IMIDAZOL-5-YL)METHYL)SULFINYL)ETHYL)GUANIDINE
Common Name English
(+)-CIMETIDINE S-OXIDE
Common Name English
CIMETIDINE SULFOXIDE, (+)-
Common Name English
Code System Code Type Description
FDA UNII
E1296X9V0X
Created by admin on Sat Dec 16 08:49:12 GMT 2023 , Edited by admin on Sat Dec 16 08:49:12 GMT 2023
PRIMARY
CAS
151258-41-2
Created by admin on Sat Dec 16 08:49:12 GMT 2023 , Edited by admin on Sat Dec 16 08:49:12 GMT 2023
PRIMARY
PUBCHEM
91800039
Created by admin on Sat Dec 16 08:49:12 GMT 2023 , Edited by admin on Sat Dec 16 08:49:12 GMT 2023
PRIMARY PUBCHEM
NIH
NCATS
PRIVACY ACT
ACCESSIBILITY
DISCLAIMER
HHS VULNERABILITY DISCLOSURE
For language access assistance, contact the NCATS Public Information Officer
National Center for Advancing Translational Sciences (NCATS),
6701 Democracy Boulevard, Bethesda MD 20892-4874 • 301-594-8966