Vitas-M small molecule compound

2-{[5-(benzylsulfanyl)-9,10-dihydro-8H-cyclopenta[4,5]thieno[3,2-e][1,2,4]triazolo[4,3-c]pyrimidin-3-yl]sulfanyl}-N-(3-chlorophenyl)acetamide

Catalog ID
STK720424
SMILES O=C(Nc1cccc(c1)Cl)CSc1nnc2n1c(SCc1ccccc1)nc1c2c2CCCc2s1

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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 C25H20ClN5OS3 MW 538.12 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H20ClN5OS3/c26-16-8-4-9-17(12-16)27-20(32)14-34-25-30-29-22-21-18-10-5-11-19(18)35-23(21)28-24(31(22)25)33-13-15-6-2-1-3-7-15/h1-4,6-9,12H,5,10-11,13-14H2,(H,27,32)
InChIKey
DOCQHUAYRFMMNV-UHFFFAOYSA-N
Synonyms
573706-06-6
2((5(benzylsulfanyl)910dihydro8Hcyclopenta(45)thieno(32e)(124)triazolo(43c)pyrimidin3yl)sulfanyl)N(3chlorophenyl)acetamide
2((5(benzylthio)910dihydro8Hcyclopenta(45)thieno(32e)(124)triazolo(43c)pyrimidin3yl)thio)N(3chlorophenyl)acetamide
573706066
C1CC2=C(C1)SC3=C2C4=NN=C(N4C(=N3)SCC5=CC=CC=C5)SCC(=O)NC6=CC(=CC=C6)Cl
InChI=1SC25H20ClN5OS3c261684917(1216)2720(32)14342530292221181051119(18)3523(21)2824(31(22)25)3313156213715h146912H510111314H2(H2732)
MFCD04018063
ZINC000002445315
ZINC2445315

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Available files

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