Vitas-M small molecule compound
3-bromo-N-(3-cyano-6-methyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-4-ethoxybenzamide
Catalog ID
STK117137
SMILES CCOc1ccc(cc1Br)C(=O)Nc1sc2c(c1C#N)CCC(C2)C
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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 C19H19BrN2O2S MW 419.34 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H19BrN2O2S/c1-3-24-16-7-5-12(9-15(16)20)18(23)22-19-14(10-21)13-6-4-11(2)8-17(13)25-19/h5,7,9,11H,3-4,6,8H2,1-2H3,(H,22,23)InChIKey
RDZIGPSHEPHPMM-UHFFFAOYSA-NSynonyms
642421-20-33bromoN(3cyano6methyl4567tetrahydro1benzothiophen2yl)4ethoxybenzamide
642421203
CCOC1=C(C=C(C=C1)C(=O)NC2=C(C3=C(S2)CC(CC3)C)C#N)Br
InChI=1SC19H19BrN2O2Sc1324167512(915(16)20)18(23)221914(1021)136411(2)817(13)2519h57911H3468H212H3(H2223)
MFCD03907780
ZINC000001111700
ZINC000001111701
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