Vitas-M small molecule compound
3-ethyl-2-methyl-3a,7a-dihydro-1,3-benzothiazol-3-ium
Catalog ID
STK377877
SMILES CC[N+]1=C(C)SC2C1C=CC=C2
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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 C10H14NS MW 180.29 g/mol Purity >90% as per NMR
InChI
InChI=1S/C10H14NS/c1-3-11-8(2)12-10-7-5-4-6-9(10)11/h4-7,9-10H,3H2,1-2H3/q+1InChIKey
MPBBVXQANLXLCB-UHFFFAOYSA-NSynonyms
3ethyl2methyl3a7adihydro13benzothiazol3ium
CC(N+)1=C(C)SC2C1C=CC=C2
CC(N+)1=C(SC2C1C=CC=C2)C
InChI=1SC10H14NSc13118(2)121075469(10)11h47910H3H212H3q+1
MFCD01823395
ZINC000004211575
ZINC000004211580
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