Vitas-M small molecule compound

propan-2-yl 2-[(ethoxycarbonyl)amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate

Catalog ID
STK447713
SMILES CCOC(=O)Nc1sc2c(c1C(=O)OC(C)C)CCCC2

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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 C15H21NO4S MW 311.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C15H21NO4S/c1-4-19-15(18)16-13-12(14(17)20-9(2)3)10-7-5-6-8-11(10)21-13/h9H,4-8H2,1-3H3,(H,16,18)
InChIKey
ISNKOUPAXKMMLQ-UHFFFAOYSA-N
Synonyms

CCOC(=O)NC1=C(C2=C(S1)CCCC2)C(=O)OC(C)C
InChI=1SC15H21NO4Sc141915(18)161312(14(17)209(2)3)10756811(10)2113h9H48H213H3(H1618)
MFCD01338305
propan2yl2((ethoxycarbonyl)amino)4567tetrahydro1benzothiophene3carboxylate
propan2yl2(ethoxycarbonylamino)4567tetrahydro1benzothiophene3carboxylate
ZINC000000433751
ZINC00433751
ZINC433751

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Available files

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