Vitas-M small molecule compound
7-benzyl-3-(4-methoxyphenyl)-2-[(2-methylprop-2-en-1-yl)sulfanyl]-5,6,7,8-tetrahydropyrido[4',3':4,5]thieno[2,3-d]pyrimidin-4(3H)-one
Catalog ID
STK698979
SMILES COc1ccc(cc1)n1c(SCC(=C)C)nc2c(c1=O)c1CCN(Cc1s2)Cc1ccccc1
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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 C27H27N3O2S2 MW 489.66 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H27N3O2S2/c1-18(2)17-33-27-28-25-24(26(31)30(27)20-9-11-21(32-3)12-10-20)22-13-14-29(16-23(22)34-25)15-19-7-5-4-6-8-19/h4-12H,1,13-17H2,2-3H3InChIKey
OCPKJCFOGVKCEF-UHFFFAOYSA-NSynonyms
352657-93-3352657933
7benzyl3(4methoxyphenyl)2((2methylallyl)thio)5678tetrahydropyrido(4345)thieno(23d)pyrimidin4(3H)one
7benzyl3(4methoxyphenyl)2((2methylprop2en1yl)sulfanyl)5678tetrahydropyrido(4345)thieno(23d)pyrimidin4(3H)one
7benzyl3(4methoxyphenyl)2(2methylprop2enylsulfanyl)68dihydro5Hpyrido(23)thieno(24b)pyrimidin4one
CC(=C)CSC1=NC2=C(C3=C(S2)CN(CC3)CC4=CC=CC=C4)C(=O)N1C5=CC=C(C=C5)OC
InChI=1SC27H27N3O2S2c118(2)173327282524(26(31)30(27)2091121(323)121020)22131429(1623(22)3425)15197546819h412H11317H223H3
MFCD01879768
ZINC000020033096
ZINC20033096
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