Vitas-M small molecule compound

2-{[4-oxo-3-(prop-2-en-1-yl)-3,4,5,6,7,8-hexahydro[1]benzothieno[2,3-d]pyrimidin-2-yl]sulfanyl}-N-phenylacetamide

Catalog ID
STK804365
SMILES C=CCn1c(SCC(=O)Nc2ccccc2)nc2c(c1=O)c1CCCCc1s2

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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 C21H21N3O2S2 MW 411.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H21N3O2S2/c1-2-12-24-20(26)18-15-10-6-7-11-16(15)28-19(18)23-21(24)27-13-17(25)22-14-8-4-3-5-9-14/h2-5,8-9H,1,6-7,10-13H2,(H,22,25)
InChIKey
WLZBDXBTQMZDNO-UHFFFAOYSA-N
Synonyms
303228-46-8
2((3allyl4oxo345678hexahydrobenzo(45)thieno(23d)pyrimidin2yl)thio)Nphenylacetamide
2((4oxo3(prop2en1yl)345678hexahydro(1)benzothieno(23d)pyrimidin2yl)sulfanyl)Nphenylacetamide
2((4oxo3prop2enyl5678tetrahydro(1)benzothiolo(23d)pyrimidin2yl)sulfanyl)Nphenylacetamide
303228468
C=CCN1C(=O)C2=C(N=C1SCC(=O)NC3=CC=CC=C3)SC4=C2CCCC4
InChI=1SC21H21N3O2S2c12122420(26)181510671116(15)2819(18)2321(24)271317(25)22148435914h2589H1671013H2(H2225)
MFCD01237933
ZINC000000628645
ZINC00628645
ZINC628645

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Available files

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