Vitas-M small molecule compound
3-(4-methylphenyl)-2-{[(2E)-3-phenylprop-2-en-1-yl]sulfanyl}-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4(3H)-one
Catalog ID
STK001328
SMILES Cc1ccc(cc1)n1c(SC/C=C/c2ccccc2)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 C26H24N2OS2 MW 444.62 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H24N2OS2/c1-18-13-15-20(16-14-18)28-25(29)23-21-11-5-6-12-22(21)31-24(23)27-26(28)30-17-7-10-19-8-3-2-4-9-19/h2-4,7-10,13-16H,5-6,11-12,17H2,1H3/b10-7+InChIKey
HZCPHIOAJBNKPR-JXMROGBWSA-NSynonyms
499104-52-82(cinnamylthio)3(ptolyl)5678tetrahydrobenzo(45)thieno(23d)pyrimidin4(3H)one
3(4methylphenyl)2(((2E)3phenylprop2en1yl)sulfanyl)5678tetrahydro(1)benzothieno(23d)pyrimidin4(3H)one
3(4methylphenyl)2((E)3phenylprop2enyl)sulfanyl5678tetrahydro(1)benzothiolo(23d)pyrimidin4one
499104528
CC1=CC=C(C=C1)N2C(=O)C3=C(N=C2SCC=CC4=CC=CC=C4)SC5=C3CCCC5
Cc1ccc(cc1)n1c(SCC=Cc2ccccc2)nc2c(c1=O)c1CCCCc1s2
InChI=1SC26H24N2OS2c118131520(161418)2825(29)232111561222(21)3124(23)2726(28)3017710198324919h247101316H56111217H21H3b107+
MFCD03224251
STK001328
ZINC000001775101
ZINC01775101
ZINC1775101
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