Vitas-M small molecule compound

N-cyclohexyl-2-{[4-(4-methylphenyl)-5-oxo-4,5,7,8-tetrahydro-6H-cyclopenta[4,5]thieno[3,2-e][1,2,4]triazolo[4,3-a]pyrimidin-1-yl]sulfanyl}acetamide

Catalog ID
STK574778
SMILES O=C(NC1CCCCC1)CSc1nnc2n1c1sc3c(c1c(=O)n2c1ccc(cc1)C)CCC3

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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 C25H27N5O2S2 MW 493.65 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H27N5O2S2/c1-15-10-12-17(13-11-15)29-22(32)21-18-8-5-9-19(18)34-23(21)30-24(29)27-28-25(30)33-14-20(31)26-16-6-3-2-4-7-16/h10-13,16H,2-9,14H2,1H3,(H,26,31)
InChIKey
ZTKYWHLHCIWMKB-UHFFFAOYSA-N
Synonyms
898609-52-4
898609524
CC1=CC=C(C=C1)N2C(=O)C3=C(N4C2=NN=C4SCC(=O)NC5CCCCC5)SC6=C3CCC6
InChI=1SC25H27N5O2S2c115101217(131115)2922(32)211885919(18)3423(21)3024(29)272825(30)331420(31)26166324716h101316H2914H21H3(H2631)
MFCD03682095
Ncyclohexyl2((4(4methylphenyl)5oxo4578tetrahydro6Hcyclopenta(45)thieno(32e)(124)triazolo(43a)pyrimidin1yl)sulfanyl)acetamide
Ncyclohexyl2((5oxo4(ptolyl)5678tetrahydro4Hcyclopenta(45)thieno(32e)(124)triazolo(43a)pyrimidin1yl)thio)acetamide
ZINC000013554897
ZINC13554897

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Available files

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