Vitas-M small molecule compound

ethyl 6-tert-butyl-2-[(methoxycarbonyl)amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate

Catalog ID
STK434443
SMILES CCOC(=O)c1c(NC(=O)OC)sc2c1CCC(C2)C(C)(C)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 C17H25NO4S MW 339.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H25NO4S/c1-6-22-15(19)13-11-8-7-10(17(2,3)4)9-12(11)23-14(13)18-16(20)21-5/h10H,6-9H2,1-5H3,(H,18,20)
InChIKey
OVFXWNYRSQMFEV-UHFFFAOYSA-N
Synonyms

CCOC(=O)C1=C(SC2=C1CCC(C2)C(C)(C)C)NC(=O)OC
ethyl6tertbutyl2((methoxycarbonyl)amino)4567tetrahydro1benzothiophene3carboxylate
ethyl6tertbutyl2(methoxycarbonylamino)4567tetrahydro1benzothiophene3carboxylate
InChI=1SC17H25NO4Sc162215(19)13118710(17(23)4)912(11)2314(13)1816(20)215h10H69H215H3(H1820)
MFCD01340681
ZINC000005020883
ZINC000005020886

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Available files

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