Vitas-M small molecule compound
3-[(4-bromophenoxy)methyl]-N-(3-cyano-4,5,6,7,8,9,10,11,12,13-decahydrocyclododeca[b]thiophen-2-yl)-4-methoxybenzamide
Catalog ID
STK302304
SMILES COc1ccc(cc1COc1ccc(cc1)Br)C(=O)Nc1sc2c(c1C#N)CCCCCCCCCC2
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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 C30H33BrN2O3S MW 581.57 g/mol Purity >90% as per NMR
InChI
InChI=1S/C30H33BrN2O3S/c1-35-27-17-12-21(18-22(27)20-36-24-15-13-23(31)14-16-24)29(34)33-30-26(19-32)25-10-8-6-4-2-3-5-7-9-11-28(25)37-30/h12-18H,2-11,20H2,1H3,(H,33,34)InChIKey
MJTJWYXHHGKLCR-UHFFFAOYSA-NSynonyms
438237-11-73((4bromophenoxy)methyl)N(3cyano45678910111213decahydrocyclododeca(b)thiophen2yl)4methoxybenzamide
438237117
COC1=C(C=C(C=C1)C(=O)NC2=C(C3=C(S2)CCCCCCCCCC3)C#N)COC4=CC=C(C=C4)Br
InChI=1SC30H33BrN2O3Sc13527171221(1822(27)203624151323(31)141624)29(34)333026(1932)2510864235791128(25)3730h1218H21120H21H3(H3334)
MFCD03468176
ZINC000002731793
ZINC02731793
ZINC2731793
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