Vitas-M small molecule compound
2-[(1E)-2-ethoxyprop-1-en-1-yl]-3-ethyl-1,3-benzothiazol-3-ium
Catalog ID
STK367948
SMILES CCO/C(=C/c1sc2c([n+]1CC)cccc2)/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 C14H18NOS MW 248.37 g/mol Purity >90% as per NMR
InChI
InChI=1S/C14H18NOS/c1-4-15-12-8-6-7-9-13(12)17-14(15)10-11(3)16-5-2/h6-10H,4-5H2,1-3H3/q+1/b11-10+InChIKey
VRDIHFWFLTVUMV-ZHACJKMWSA-NSynonyms
2((1E)2ethoxyprop1en1yl)3ethyl13benzothiazol3ium
2((E)2ETHOXYPROP1ENYL)3ETHYL13BENZOTHIAZOL3IUM
2(2ETHOXYPROPENYL)3ETHYLBENZOTHIAZOL3IUM
CC(N+)1=C(SC2=CC=CC=C21)C=C(C)OCC
CCOC(=Cc1sc2c((n+)1CC)cccc2)C
InChI=1SC14H18NOSc141512867913(12)1714(15)1011(3)1652h610H45H213H3q+1b1110+
MFCD00473485
ZINC000000320216
ZINC00320216
ZINC320216
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