Esomeprazole magnesium
CAS Registry Number®
161973-10-0
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CAS Name
Esomeprazole magnesiumMolecular Formula
C34H36MgN6O6S2Cite this Page
Esomeprazole magnesium. CAS Common Chemistry. CAS, a division of the American Chemical Society, n.d. http://commonchemistry.cas.org/detail?ref=161973-10-0 (retrieved ) (CAS RN: 161973-10-0). Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).Other Names and Identifiers
InChI
InChI=1S/2C17H18N3O3S.Mg/c2*1-10-8-18-15(11(2)16(10)23-4)9-24(21)17-19-13-6-5-12(22-3)7-14(13)20-17;/h2*5-8H,9H2,1-4H3;/q2*-1;+2
InChIKey
InChIKey=KWORUUGOSLYAGD-UHFFFAOYSA-N
SMILES
C(S1=O[Mg+2]2([N]3=C(S(CC4=C(C)C(OC)=C(C)C=N4)=O2)[N-]C=5C3=CC=C(OC)C5)[N]6=C1[N-]C=7C6=CC=C(OC)C7)C8=C(C)C(OC)=C(C)C=N8
Canonical SMILES
N=1C=C(C(OC)=C(C1CS2=O[Mg+2]3(O=S(C=4[N-]C=5C=C(OC)C=CC5[N]43)CC6=NC=C(C(OC)=C6C)C)[N]7=C2[N-]C=8C=C(OC)C=CC87)C)C
Other Names for this Substance
- Magnesium, bis[6-methoxy-2-[(S)-[(4-methoxy-3,5-dimethyl-2-pyridinyl)methyl]sulfinyl-κO]-1H-benzimidazolato-κN3]-, (T-4)-
- Magnesium, bis[5-methoxy-2-[[(4-methoxy-3,5-dimethyl-2-pyridinyl)methyl]sulfinyl]-1H-benzimidazolato]-, [T-4-(S),(S)]-
- (T-4)-Bis[6-methoxy-2-[(S)-[(4-methoxy-3,5-dimethyl-2-pyridinyl)methyl]sulfinyl-κO]-1H-benzimidazolato-κN3]magnesium
- Esomeprazole magnesium
- H 199/18
Deleted or Replaced CAS Registry Numbers
302841-07-2, 320416-93-1, 371759-50-1, 372519-57-8, 376628-34-1, 502497-87-2, 870780-01-1, 202742-32-3, 922731-05-3
