Vitas-M small molecule compound
7-benzyl-2-{[(2Z)-3-chlorobut-2-en-1-yl]sulfanyl}-3-phenyl-5,6,7,8-tetrahydropyrido[4',3':4,5]thieno[2,3-d]pyrimidin-4(3H)-one
Catalog ID
STK541209
SMILES C/C(=C/CSc1nc2sc3c(c2c(=O)n1c1ccccc1)CCN(C3)Cc1ccccc1)/Cl
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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 C26H24ClN3OS2 MW 494.08 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H24ClN3OS2/c1-18(27)13-15-32-26-28-24-23(25(31)30(26)20-10-6-3-7-11-20)21-12-14-29(17-22(21)33-24)16-19-8-4-2-5-9-19/h2-11,13H,12,14-17H2,1H3/b18-13-InChIKey
JCYDEJRUSKWZOJ-AQTBWJFISA-NSynonyms
384372-95-6(Z)7benzyl2((3chlorobut2en1yl)thio)3phenyl5678tetrahydropyrido(4345)thieno(23d)pyrimidin4(3H)one
384372956
7benzyl2(((2Z)3chlorobut2en1yl)sulfanyl)3phenyl5678tetrahydropyrido(4345)thieno(23d)pyrimidin4(3H)one
7benzyl2((Z)3chlorobut2enyl)sulfanyl3phenyl68dihydro5Hpyrido(23)thieno(24b)pyrimidin4one
CC(=CCSC1=NC2=C(C3=C(S2)CN(CC3)CC4=CC=CC=C4)C(=O)N1C5=CC=CC=C5)Cl
CC(=CCSc1nc2sc3c(c2c(=O)n1c1ccccc1)CCN(C3)Cc1ccccc1)Cl
InChI=1SC26H24ClN3OS2c118(27)13153226282423(25(31)30(26)20106371120)21121429(1722(21)3324)16198425919h21113H121417H21H3b1813
MFCD03284882
ZINC000020057747
ZINC20057747
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