Vitas-M small molecule compound

1-{4-[2-(methylsulfanyl)-6,7-dihydro-5H-cyclopenta[4,5]thieno[2,3-d]pyrimidin-4-yl]piperazin-1-yl}ethanone

Catalog ID
STK649096
SMILES CSc1nc(N2CCN(CC2)C(=O)C)c2c(n1)sc1c2CCC1

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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 C16H20N4OS2 MW 348.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H20N4OS2/c1-10(21)19-6-8-20(9-7-19)14-13-11-4-3-5-12(11)23-15(13)18-16(17-14)22-2/h3-9H2,1-2H3
InChIKey
IQROYVOEQWSWAK-UHFFFAOYSA-N
Synonyms
1144494-48-3
1(4(2(methylsulfanyl)67dihydro5Hcyclopenta(45)thieno(23d)pyrimidin4yl)piperazin1yl)ethanone
1(4(2(methylthio)67dihydro5Hcyclopenta(45)thieno(23d)pyrimidin4yl)piperazin1yl)ethanone
1(4(3methylsulfanyl78dihydro6Hcyclopenta(45)thieno(12c)pyrimidin1yl)piperazin1yl)ethanone
1144494483
CC(=O)N1CCN(CC1)C2=C3C4=C(CCC4)SC3=NC(=N2)SC
InChI=1SC16H20N4OS2c110(21)196820(9719)14131143512(11)2315(13)1816(1714)222h39H212H3
MFCD12212735
ZINC000032087988
ZINC32087988

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Available files

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