Vitas-M small molecule compound
N-{3-chloro-4-[(2-fluorobenzyl)oxy]-5-methoxybenzyl}-2-[(1-methyl-1H-tetrazol-5-yl)sulfanyl]ethanamine
Catalog ID
STK728670
SMILES COc1cc(CNCCSc2nnnn2C)cc(c1OCc1ccccc1F)Cl
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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 C19H21ClFN5O2S MW 437.93 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H21ClFN5O2S/c1-26-19(23-24-25-26)29-8-7-22-11-13-9-15(20)18(17(10-13)27-2)28-12-14-5-3-4-6-16(14)21/h3-6,9-10,22H,7-8,11-12H2,1-2H3InChIKey
QSPMUGIUDDKZJF-UHFFFAOYSA-NSynonyms
CN1C(=NN=N1)SCCNCC2=CC(=C(C(=C2)Cl)OCC3=CC=CC=C3F)OC
COc1cc(CNCCSc2nnnn2C)cc(c1OCc1ccccc1F)ClCl
InChI=1SC19H21ClFN5O2Sc12619(23242526)2987221113915(20)18(17(1013)272)281214534616(14)21h3691022H781112H212H3
MFCD06752505
N((3CHLORO4((2FLUOROPHENYL)METHOXY)5METHOXYPHENYL)METHYL)2(1METHYLTETRAZOL5YL)SULFANYLETHANAMINE
N(3chloro4((2fluorobenzyl)oxy)5methoxybenzyl)2((1methyl1Htetrazol5yl)sulfanyl)ethanamine
N(3chloro4((2fluorobenzyl)oxy)5methoxybenzyl)2((1methyl1Htetrazol5yl)thio)ethanaminehydrochloride
N(3CHLORO4((2FLUOROBENZYL)OXY)5METHOXYBENZYL)N(2((1METHYL1HTETRAAZOL5YL)SULFANYL)ETHYL)AMINE
ZINC000009488148
ZINC9488148
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