Vitas-M small molecule compound
2-{[2-(naphthalen-2-yl)-2-oxoethyl]sulfanyl}-3-(prop-2-en-1-yl)-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4(3H)-one
Catalog ID
STL341302
SMILES C=CCn1c(SCC(=O)c2ccc3c(c2)cccc3)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 C25H22N2O2S2 MW 446.59 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H22N2O2S2/c1-2-13-27-24(29)22-19-9-5-6-10-21(19)31-23(22)26-25(27)30-15-20(28)18-12-11-16-7-3-4-8-17(16)14-18/h2-4,7-8,11-12,14H,1,5-6,9-10,13,15H2InChIKey
CQTGEOOETMZJJH-UHFFFAOYSA-NSynonyms
575471-21-52((2(naphthalen2yl)2oxoethyl)sulfanyl)3(prop2en1yl)5678tetrahydro(1)benzothieno(23d)pyrimidin4(3H)one
2(2naphthalen2yl2oxoethyl)sulfanyl3prop2enyl5678tetrahydro(1)benzothiolo(23d)pyrimidin4one
3allyl2((2(naphthalen2yl)2oxoethyl)thio)5678tetrahydrobenzo(45)thieno(23d)pyrimidin4(3H)one
575471215
C=CCN1C(=O)C2=C(N=C1SCC(=O)C3=CC4=CC=CC=C4C=C3)SC5=C2CCCC5
InChI=1SC25H22N2O2S2c12132724(29)22199561021(19)3123(22)2625(27)301520(28)18121116734817(16)1418h2478111214H1569101315H2
MFCD04026415
ZINC000002376197
ZINC02376197
ZINC2376197
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