Vitas-M small molecule compound

ethyl 4-[4-oxo-3-(propan-2-yl)-3,4,5,6,7,8-hexahydro[1]benzothieno[2,3-d]pyrimidin-2-yl]piperazine-1-carboxylate

Catalog ID
STK643193
SMILES CCOC(=O)N1CCN(CC1)c1nc2sc3c(c2c(=O)n1C(C)C)CCCC3

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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 C20H28N4O3S MW 404.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H28N4O3S/c1-4-27-20(26)23-11-9-22(10-12-23)19-21-17-16(18(25)24(19)13(2)3)14-7-5-6-8-15(14)28-17/h13H,4-12H2,1-3H3
InChIKey
GLIPSTXBFLHDSZ-UHFFFAOYSA-N
Synonyms
1081118-13-9
1081118139
CCOC(=O)N1CCN(CC1)C2=NC3=C(C4=C(S3)CCCC4)C(=O)N2C(C)C
ethyl4(3isopropyl4oxo345678hexahydrobenzo(45)thieno(23d)pyrimidin2yl)piperazine1carboxylate
ethyl4(4oxo3(propan2yl)345678hexahydro(1)benzothieno(23d)pyrimidin2yl)piperazine1carboxylate
ethyl4(4oxo3propan2yl5678tetrahydro(1)benzothiolo(23d)pyrimidin2yl)piperazine1carboxylate
InChI=1SC20H28N4O3Sc142720(26)2311922(101223)19211716(18(25)24(19)13(2)3)14756815(14)2817h13H412H213H3
MFCD12210622
ZINC000020745956
ZINC20745956

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Available files

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