Vitas-M small molecule compound

ethyl 4-{[(3-carbamoyl-5,6-dihydro-4H-cyclopenta[b]thiophen-2-yl)amino](oxo)acetyl}piperazine-1-carboxylate

Catalog ID
STK616408
SMILES CCOC(=O)N1CCN(CC1)C(=O)C(=O)Nc1sc2c(c1C(=O)N)CCC2

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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 C17H22N4O5S MW 394.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H22N4O5S/c1-2-26-17(25)21-8-6-20(7-9-21)16(24)14(23)19-15-12(13(18)22)10-4-3-5-11(10)27-15/h2-9H2,1H3,(H2,18,22)(H,19,23)
InChIKey
VBKLOWKVBMSMFU-UHFFFAOYSA-N
Synonyms
903586-97-0
903586970
CCOC(=O)N1CCN(CC1)C(=O)C(=O)NC2=C(C3=C(S2)CCC3)C(=O)N
ethyl4(((3carbamoyl56dihydro4Hcyclopenta(b)thiophen2yl)amino)(oxo)acetyl)piperazine1carboxylate
ETHYL4(2((3CARBAMOYL56DIHYDRO4HCYCLOPENTA(B)THIOPHEN2YL)AMINO)2OXOACETYL)PIPERAZINE1CARBOXYLATE
InChI=1SC17H22N4O5Sc122617(25)218620(7921)16(24)14(23)191512(13(18)22)1043511(10)2715h29H21H3(H21822)(H1923)
MFCD08286296
ZINC000006669448
ZINC06669448
ZINC6669448

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Available files

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