Vitas-M small molecule compound

ethyl 4-(4-tert-butylphenyl)-2-[(4,5,6,7-tetrahydro-1-benzothiophen-3-ylcarbonyl)amino]thiophene-3-carboxylate

Catalog ID
STK423319
SMILES CCOC(=O)c1c(scc1c1ccc(cc1)C(C)(C)C)NC(=O)c1csc2c1CCCC2

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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 C26H29NO3S2 MW 467.65 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H29NO3S2/c1-5-30-25(29)22-19(16-10-12-17(13-11-16)26(2,3)4)14-32-24(22)27-23(28)20-15-31-21-9-7-6-8-18(20)21/h10-15H,5-9H2,1-4H3,(H,27,28)
InChIKey
RPVGHEVEBXZNBX-UHFFFAOYSA-N
Synonyms

CCOC(=O)C1=C(SC=C1C2=CC=C(C=C2)C(C)(C)C)NC(=O)C3=CSC4=C3CCCC4
ethyl4(4tertbutylphenyl)2((4567tetrahydro1benzothiophen3ylcarbonyl)amino)thiophene3carboxylate
ethyl4(4tertbutylphenyl)2(4567tetrahydro1benzothiophene3carbonylamino)thiophene3carboxylate
InChI=1SC26H29NO3S2c153025(29)2219(16101217(131116)26(23)4)143224(22)2723(28)20153121976818(20)21h1015H59H214H3(H2728)
MFCD02244441
ZINC000002107571
ZINC02107571
ZINC2107571

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Available files

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