Vitas-M small molecule compound
2-(2-bromo-6-ethoxy-4-{[(3-sulfanyl-4H-1,2,4-triazol-4-yl)amino]methyl}phenoxy)-N-cyclohexylacetamide
Catalog ID
STK511135
SMILES CCOc1cc(CNn2cnnc2S)cc(c1OCC(=O)NC1CCCCC1)Br
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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 C19H26BrN5O3S MW 484.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H26BrN5O3S/c1-2-27-16-9-13(10-22-25-12-21-24-19(25)29)8-15(20)18(16)28-11-17(26)23-14-6-4-3-5-7-14/h8-9,12,14,22H,2-7,10-11H2,1H3,(H,23,26)(H,24,29)InChIKey
IEOJTRUPYKQWNJ-UHFFFAOYSA-NSynonyms
2(2bromo6ethoxy4(((3sulfanyl4H124triazol4yl)amino)methyl)phenoxy)Ncyclohexylacetamide
2(2BROMO6ETHOXY4(((5SULFANYLIDENE1H124TRIAZOL4YL)AMINO)METHYL)PHENOXY)NCYCLOHEXYLACETAMIDE
CCOC1=C(C(=CC(=C1)CNN2C=NNC2=S)Br)OCC(=O)NC3CCCCC3
InChI=1SC19H26BrN5O3Sc122716913(10222512212419(25)29)815(20)18(16)281117(26)23146435714h89121422H271011H21H3(H2326)(H2429)
MFCD05134740
ZINC000000679654
ZINC00679654
ZINC679654
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