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Details

Stereochemistry ABSOLUTE
Molecular Formula C20H24N2O4S
Molecular Weight 388.481
Optical Activity UNSPECIFIED
Defined Stereocenters 2 / 2
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of Deacetyl Diltiazem N-Oxide

SMILES

COC1=CC=C(C=C1)[C@@H]2SC3=CC=CC=C3N(CC[N+](C)(C)[O-])C(=O)[C@@H]2O

InChI

InChIKey=IUGDJMNXZDLMHP-MOPGFXCFSA-N
InChI=1S/C20H24N2O4S/c1-22(2,25)13-12-21-16-6-4-5-7-17(16)27-19(18(23)20(21)24)14-8-10-15(26-3)11-9-14/h4-11,18-19,23H,12-13H2,1-3H3/t18-,19+/m1/s1

HIDE SMILES / InChI

Approval Year

Unknown
139594
Name Type Language
Deacetyl Diltiazem N-Oxide
Common Name English
1,5-Benzothiazepin-4(5H)-one, 5-[2-(dimethyloxidoamino)ethyl]-2,3-dihydro-3-hydroxy-2-(4-methoxyphenyl)-, (2S,3S)-
Systematic Name English
(2S,3S)-5-[2-(Dimethyloxidoamino)ethyl]-2,3-dihydro-3-hydroxy-2-(4-methoxyphenyl)-1,5-benzothiazepin-4(5H)-one
Systematic Name English
Deacetyldiltiazem N-oxide
Common Name English
Code System Code Type Description
CAS
122619-90-3
Created by admin on Sat Dec 16 19:19:36 GMT 2023 , Edited by admin on Sat Dec 16 19:19:36 GMT 2023
PRIMARY
FDA UNII
8JR44YR7QC
Created by admin on Sat Dec 16 19:19:36 GMT 2023 , Edited by admin on Sat Dec 16 19:19:36 GMT 2023
PRIMARY
PUBCHEM
71315210
Created by admin on Sat Dec 16 19:19:36 GMT 2023 , Edited by admin on Sat Dec 16 19:19:36 GMT 2023
PRIMARY
EPA CompTox
DTXSID00747423
Created by admin on Sat Dec 16 19:19:36 GMT 2023 , Edited by admin on Sat Dec 16 19:19:36 GMT 2023
PRIMARY
NIH
NCATS
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