Vitas-M small molecule compound
4-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-1,3-thiazol-2-aminium
Catalog ID
STL016147
SMILES [NH3+]c1scc(n1)c1ccc2c(c1)OCCCO2
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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 C12H13N2O2S MW 249.31 g/mol Purity >90% as per NMR
InChI
InChI=1S/C12H12N2O2S/c13-12-14-9(7-17-12)8-2-3-10-11(6-8)16-5-1-4-15-10/h2-3,6-7H,1,4-5H2,(H2,13,14)/p+1InChIKey
ATRBJXZCQKLIBW-UHFFFAOYSA-OSynonyms
(4(34dihydro2H15benzodioxepin7yl)13thiazol2yl)azanium
(NH3+)c1scc(n1)c1ccc2c(c1)OCCCO2
4(34dihydro2H15benzodioxepin7yl)13thiazol2aminium
C1COC2=C(C=C(C=C2)C3=CSC(=N3)(NH3+))OC1
InChI=1SC12H12N2O2Sc1312149(71712)8231011(68)165141510h2367H145H2(H21314)p+1
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