Vitas-M small molecule compound
7-benzyl-3-cyclohexyl-2-[(naphthalen-1-ylmethyl)sulfanyl]-5,6,7,8-tetrahydropyrido[4',3':4,5]thieno[2,3-d]pyrimidin-4(3H)-one
Catalog ID
STK530972
SMILES O=c1n(C2CCCCC2)c(SCc2cccc3c2cccc3)nc2c1c1CCN(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 C33H33N3OS2 MW 551.78 g/mol Purity >90% as per NMR
InChI
InChI=1S/C33H33N3OS2/c37-32-30-28-18-19-35(20-23-10-3-1-4-11-23)21-29(28)39-31(30)34-33(36(32)26-15-5-2-6-16-26)38-22-25-14-9-13-24-12-7-8-17-27(24)25/h1,3-4,7-14,17,26H,2,5-6,15-16,18-22H2InChIKey
TVCFNPXVYXQFRY-UHFFFAOYSA-NSynonyms
7benzyl3cyclohexyl2((naphthalen1ylmethyl)sulfanyl)5678tetrahydropyrido(4345)thieno(23d)pyrimidin4(3H)one
7benzyl3cyclohexyl2((naphthalen1ylmethyl)thio)5678tetrahydropyrido(4345)thieno(23d)pyrimidin4(3H)one
7benzyl3cyclohexyl2(naphthalen1ylmethylsulfanyl)68dihydro5Hpyrido(23)thieno(24b)pyrimidin4one
C1CCC(CC1)N2C(=O)C3=C(N=C2SCC4=CC=CC5=CC=CC=C54)SC6=C3CCN(C6)CC7=CC=CC=C7
InChI=1SC33H33N3OS2c37323028181935(2023103141123)2129(28)3931(30)3433(36(32)26155261626)382225149132412781727(24)25h1347141726H25615161822H2
MFCD02241244
ZINC000001773991
ZINC1773991
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