Vitas-M small molecule compound

N-(3-cyano-6-ethyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-4-(difluoromethoxy)benzamide

Catalog ID
STK965972
SMILES CCC1CCc2c(C1)sc(c2C#N)NC(=O)c1ccc(cc1)OC(F)F

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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 C19H18F2N2O2S MW 376.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H18F2N2O2S/c1-2-11-3-8-14-15(10-22)18(26-16(14)9-11)23-17(24)12-4-6-13(7-5-12)25-19(20)21/h4-7,11,19H,2-3,8-9H2,1H3,(H,23,24)
InChIKey
MXCBOXCKUBWQPS-UHFFFAOYSA-N
Synonyms
754196-12-8
754196128
CCC1CCC2=C(C1)SC(=C2C#N)NC(=O)C3=CC=C(C=C3)OC(F)F
InChI=1SC19H18F2N2O2Sc1211381415(1022)18(2616(14)911)2317(24)124613(7512)2519(20)21h471119H2389H21H3(H2324)
MFCD03468624
N(3cyano6ethyl4567tetrahydro1benzothiophen2yl)4(difluoromethoxy)benzamide
ZINC000002735546
ZINC000002735547

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.