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(4aS,8aR)-N-cyclohexyl-4a,5,6,7,8,8a-hexahydro-4,1,2-benzoxathiazin-3-amine 1,1-dioxide


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Chemical Component Summary

Name(4aS,8aR)-N-cyclohexyl-4a,5,6,7,8,8a-hexahydro-4,1,2-benzoxathiazin-3-amine 1,1-dioxide
Identifiers(4aS,8aR)-N-cyclohexyl-1,1-bis(oxidanylidene)-4a,5,6,7,8,8a-hexahydro-4,1$l^{6},2-benzoxathiazin-3-amine
FormulaC13 H22 N2 O3 S
Molecular Weight286.39
TypeNON-POLYMER
Isomeric SMILESC1CCC(CC1)NC2=NS(=O)(=O)[C@@H]3CCCC[C@@H]3O2
InChIInChI=1S/C13H22N2O3S/c16-19(17)12-9-5-4-8-11(12)18-13(15-19)14-10-6-2-1-3-7-10/h10-12H,1-9H2,(H,14,15)/t11-,12+/m0/s1
InChIKeyZMDVQNCMHSXAPA-NWDGAFQWSA-N

Chemical Details

Formal Charge0
Atom Count41
Chiral Atom Count2
Bond Count43
Aromatic Bond Count0

Related Resource References

Resource NameReference
Pharos CHEMBL2409730
PubChem 66550645, 135566823
ChEMBL CHEMBL2409730