Vitas-M small molecule compound
N-{3-chloro-4-[(4-fluorobenzyl)oxy]-5-methoxybenzyl}-2-[(1-methyl-1H-tetrazol-5-yl)sulfanyl]ethanamine
Catalog ID
STK281059
SMILES COc1cc(CNCCSc2nnnn2C)cc(c1OCc1ccc(cc1)F)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)29-8-7-22-11-14-9-16(20)18(17(10-14)27-2)28-12-13-3-5-15(21)6-4-13/h3-6,9-10,22H,7-8,11-12H2,1-2H3InChIKey
QKKQRYFSIPXODK-UHFFFAOYSA-NSynonyms
CN1C(=NN=N1)SCCNCC2=CC(=C(C(=C2)Cl)OCC3=CC=C(C=C3)F)OC
COc1cc(CNCCSc2nnnn2C)cc(c1OCc1ccc(cc1)F)ClCl
InChI=1SC19H21ClFN5O2Sc12619(23242526)2987221114916(20)18(17(1014)272)2812133515(21)6413h3691022H781112H212H3
MFCD06752528
N((3CHLORO4((4FLUOROPHENYL)METHOXY)5METHOXYPHENYL)METHYL)2(1METHYLTETRAZOL5YL)SULFANYLETHANAMINE
N(3chloro4((4fluorobenzyl)oxy)5methoxybenzyl)2((1methyl1Htetrazol5yl)sulfanyl)ethanamine
N(3chloro4((4fluorobenzyl)oxy)5methoxybenzyl)2((1methyl1Htetrazol5yl)thio)ethanaminehydrochloride
N(3CHLORO4((4FLUOROBENZYL)OXY)5METHOXYBENZYL)N(2((1METHYL1HTETRAAZOL5YL)SULFANYL)ETHYL)AMINE
ZINC000009449066
ZINC9449066
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