Vitas-M small molecule compound
2-{[2-(4-bromophenyl)-2-oxoethyl]sulfanyl}-6,6-dimethyl-3-(prop-2-en-1-yl)-3,5,6,8-tetrahydro-4H-thiopyrano[4',3':4,5]thieno[2,3-d]pyrimidin-4-one
Catalog ID
STK543421
SMILES C=CCn1c(SCC(=O)c2ccc(cc2)Br)nc2c(c1=O)c1CC(C)(C)SCc1s2
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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 C22H21BrN2O2S3 MW 521.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H21BrN2O2S3/c1-4-9-25-20(27)18-15-10-22(2,3)29-12-17(15)30-19(18)24-21(25)28-11-16(26)13-5-7-14(23)8-6-13/h4-8H,1,9-12H2,2-3H3InChIKey
ALANMRZWSACBCF-UHFFFAOYSA-NSynonyms
488793-73-32((2(4bromophenyl)2oxoethyl)sulfanyl)66dimethyl3(prop2en1yl)3568tetrahydro4Hthiopyrano(4345)thieno(23d)pyrimidin4one
2(2(4bromophenyl)2oxoethyl)sulfanyl66dimethyl3prop2enyl58dihydrothiopyrano(23)thieno(24b)pyrimidin4one
3allyl2((2(4bromophenyl)2oxoethyl)thio)66dimethyl56dihydro3Hthiopyrano(4345)thieno(23d)pyrimidin4(8H)one
488793733
CC1(CC2=C(CS1)SC3=C2C(=O)N(C(=N3)SCC(=O)C4=CC=C(C=C4)Br)CC=C)C
InChI=1SC22H21BrN2O2S3c1492520(27)18151022(23)291217(15)3019(18)2421(25)281116(26)135714(23)8613h48H1912H223H3
MFCD03292626
ZINC000002341791
ZINC2341791
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