Vitas-M small molecule compound

2-tert-butyl-2,3-dihydropyrido[1,2-b][1,4,2]oxathiazin-5-ium

Catalog ID
STK328865
SMILES CC(C1CO[n+]2c(S1)cccc2)(C)C

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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.

We do not supply quantities above 5 g.

Structure and other identifiers

2D representation rendered from the SMILES, with core physicochemical data.
Formula C11H16NOS MW 210.32 g/mol Purity >90% as per NMR
InChI
InChI=1S/C11H16NOS/c1-11(2,3)9-8-13-12-7-5-4-6-10(12)14-9/h4-7,9H,8H2,1-3H3/q+1
InChIKey
MFMWVHWKNVLHTP-UHFFFAOYSA-N
Synonyms

2tertbutyl23dihydropyrido(12b)(142)oxathiazin5ium
CC(C)(C)C1CO(N+)2=CC=CC=C2S1
CC(C1CO(n+)2c(S1)cccc2)(C)C
InChI=1SC11H16NOSc111(23)981312754610(12)149h479H8H213H3q+1
MFCD10465688
ZINC000018191246
ZINC000018191249

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.