Substance

ID:1824645

Names and Identifiers
IUPAC Traditional name
diltiazem
IUPAC name
(2S,3S)-5-[2-(dimethylamino)ethyl]-2-(4-methoxyphenyl)-4-oxo-2,3,4,5-tetrahydro-1,5-benzothiazepin-3-yl acetate
Synonyms
diltiazem(+)-cis-5-[2-(dimethylamino)ethyl]-2,3-dihydro-3-hydroxy-2-(p-methoxyphenyl)-1,5-benzothiazepin-4(5H)-one acetate ester(2S,3S)-5-(2-(dimethylamino)ethyl)-2-(4-methoxyphenyl)-4-oxo-2,3,4,5-tetrahydrobenzo[b][1,4]thiazepin-3-yl acetate(2S-cis)-3-(acetyloxy)-5-[2-(dimethylamino)ethyl]-2,3-dihydro-2-(4-methoxyphenyl)-1,5-benzothiazepin-4(5H)-oneAcetic acid (2S,3S)-5-(2-dimethylamino-ethyl)-2-(4-methoxy-phenyl)-4-oxo-2,3,4,5-tetrahydro-benzo[b][1,4]thiazepin-3-yl esterD-cis-diltiazemd-cis-diltiazem
International Nonproprietary Name (INN)
diltiazemdiltiazemum
Registration numbers
PubChem CID
39186
CAS Number
42399-41-7
KEGG ID
C06958
LINCS Database
LSM-2523
Reaxys Registry
3573079
ACToR Database
42399-41-7144604-00-2
BRENDA Ligand Database
22938922938830986134730133916
CHEMBL
CHEMBL23
CompTox Database
DTXSID9022940
Protein Data Bank
6jpb
SureChEMBL Database
SCHEMBL17776
Beilstein Number
3573079
HMDB Database
HMDB0014487
Wikipedia Title
Diltiazem
DrugBank ID
DB00343
Drug Central Database
897
BindingDB Database
50004704
KEGG DRUG Database
D07845
Reactom Database
R-HSA-9614031
VSDB Database
1,863
PubChem SID
85306411
Properties
No Data Available
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Molecule Details
A 5-[2-(dimethylamino)ethyl]-2-(4-methoxyphenyl)-4-oxo-2,3,4,5-tetrahydro-1,5-benzothiazepin-3-yl acetate in which both stereocentres have S configuration. A calcium-channel blocker and vasodilator, it is used as the hydrochloride in the management of angina pectoris and hypertension.
Molecular Spectra
No Data Available
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References
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