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Zantac

ChemSpider ID: 43590
Molecular Formula: C₁₃H₂₃ClN₄O₃S
Average mass: 350.864685 Da
Monoisotopic mass: 350.11795 Da
Systematic name

N-{2-[({5-[(Dimethylamino)methyl]-2-furyl}methyl)sulfanyl]ethyl}-N'-methyl-2-nitro-1,1-ethenediamine hydrochloride (1:1)
SMILES and InChIs

SMILES:

Cl.[O-][N+](=O)C=C(NC)NCCSCc1oc(cc1)CN(C)C Copied

Std. InChI:

InChI=1S/C13H22N4O3S.ClH/c1-14-13(9-17(18)19)15-6-7-21-10-12-5-4-11(20-12)8-16(2)3;/h4-5,9,14-15H,6-8,10H2,1-3H3;1H Copied

Std. InChIKey:

GGWBHVILAJZWKJ-UHFFFAOYSA-N Copied
Cite this record
CSID:43590, http://www.chemspider.com/Chemical-Structure.43590.html (accessed 07:19, Jun 18, 2013) Copied

Validated by Experts, Validated by Users, Non-Validated, Removed by Users, Redirected by Users, Redirect Approved by Experts

Zantac

71130-06-8 [RN]

Predicted data is generated using the ACD/Labs’ ACD/PhysChem Suite, for more information see their website.

Click to predict properties on the Chemicalize site

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