Vitas-M small molecule compound

1-(4-bromophenyl)-2-[(2-ethyl-6,6-dimethyl-5,8-dihydro-6H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-4-yl)sulfanyl]ethanone

Catalog ID
STK545662
SMILES CCc1nc(SCC(=O)c2ccc(cc2)Br)c2c(n1)sc1c2CC(OC1)(C)C

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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 C21H21BrN2O2S2 MW 477.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H21BrN2O2S2/c1-4-17-23-19(27-11-15(25)12-5-7-13(22)8-6-12)18-14-9-21(2,3)26-10-16(14)28-20(18)24-17/h5-8H,4,9-11H2,1-3H3
InChIKey
RWTFNAFFOKKQHQ-UHFFFAOYSA-N
Synonyms
500197-30-8
1(4bromophenyl)2((2ethyl66dimethyl58dihydro6Hpyrano(4345)thieno(23d)pyrimidin4yl)sulfanyl)ethanone
1(4bromophenyl)2((2ethyl66dimethyl58dihydropyrano(23)thieno(24d)pyrimidin4yl)sulfanyl)ethanone
1(4bromophenyl)2((2ethyl66dimethyl68dihydro5Hpyrano(4345)thieno(23d)pyrimidin4yl)thio)ethanone
500197308
CCC1=NC2=C(C3=C(S2)COC(C3)(C)C)C(=N1)SCC(=O)C4=CC=C(C=C4)Br
InChI=1SC21H21BrN2O2S2c14172319(271115(25)125713(22)8612)1814921(23)261016(14)2820(18)2417h58H4911H213H3
MFCD03305083
ZINC000002361119
ZINC02361119
ZINC2361119

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Available files

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