Vitas-M small molecule compound

N-(4-bromophenyl)-2-{[10-ethyl-10-methyl-5-(methylsulfanyl)-10,11-dihydro-8H-pyrano[4',3':4,5]thieno[3,2-e][1,2,4]triazolo[4,3-c]pyrimidin-3-yl]sulfanyl}acetamide

Catalog ID
STL035097
SMILES CCC1(C)OCc2c(C1)c1c(s2)nc(n2c1nnc2SCC(=O)Nc1ccc(cc1)Br)SC

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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 C22H22BrN5O2S3 MW 564.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H22BrN5O2S3/c1-4-22(2)9-14-15(10-30-22)33-19-17(14)18-26-27-21(28(18)20(25-19)31-3)32-11-16(29)24-13-7-5-12(23)6-8-13/h5-8H,4,9-11H2,1-3H3,(H,24,29)
InChIKey
WEBVUCYLPKUYNX-UHFFFAOYSA-N
Synonyms

CCC1(CC2=C(CO1)SC3=C2C4=NN=C(N4C(=N3)SC)SCC(=O)NC5=CC=C(C=C5)Br)C
InChI=1SC22H22BrN5O2S3c1422(2)91415(103022)331917(14)18262721(28(18)20(2519)313)321116(29)24137512(23)6813h58H4911H213H3(H2429)
MFCD03682065
N(4bromophenyl)2((10ethyl10methyl5(methylsulfanyl)1011dihydro8Hpyrano(4345)thieno(32e)(124)triazolo(43c)pyrimidin3yl)sulfanyl)acetamide
N(4bromophenyl)2((10ethyl10methyl5(methylthio)1011dihydro8Hpyrano(4345)thieno(32e)(124)triazolo(43c)pyrimidin3yl)thio)acetamide
ZINC000001872388
ZINC000001872389

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Available files

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