Vitas-M small molecule compound

N-benzyl-2-{[4-(4-chlorophenyl)-7-methyl-5-oxo-4,5,6,7,8,9-hexahydro[1]benzothieno[3,2-e][1,2,4]triazolo[4,3-a]pyrimidin-1-yl]sulfanyl}acetamide

Catalog ID
STK555623
SMILES CC1CCc2c(C1)c1c(s2)n2c(SCC(=O)NCc3ccccc3)nnc2n(c1=O)c1ccc(cc1)Cl

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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 C27H24ClN5O2S2 MW 550.10 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H24ClN5O2S2/c1-16-7-12-21-20(13-16)23-24(35)32(19-10-8-18(28)9-11-19)26-30-31-27(33(26)25(23)37-21)36-15-22(34)29-14-17-5-3-2-4-6-17/h2-6,8-11,16H,7,12-15H2,1H3,(H,29,34)
InChIKey
HBYZJMOIRYIJFW-UHFFFAOYSA-N
Synonyms
842964-59-4
CC1CCC2=C(C1)C3=C(S2)N4C(=NN=C4SCC(=O)NCC5=CC=CC=C5)N(C3=O)C6=CC=C(C=C6)Cl
Nbenzyl2((4(4chlorophenyl)7methyl5oxo456789hexahydro(1)benzothieno(32e)(124)triazolo(43a)pyrimidin1yl)sulfanyl)acetamide
Nbenzyl2((4(4chlorophenyl)7methyl5oxo456789hexahydrobenzo(45)thieno(32e)(124)triazolo(43a)pyrimidin1yl)thio)acetamide
Registry IDs
MFCD04012476
ZINC000002403633
ZINC000002403634

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Available files

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