Vitas-M small molecule compound
2-[(4-ethyl-5-oxo-5,7-dihydro-4H-spiro[benzo[h][1,2,4]triazolo[4,3-a]quinazoline-6,1'-cyclohexan]-1-yl)sulfanyl]acetamide
Catalog ID
STK835540
SMILES CCn1c2nnc(n2c2c(c1=O)C1(CCCCC1)Cc1c2cccc1)SCC(=O)N
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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 C22H25N5O2S MW 423.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H25N5O2S/c1-2-26-19(29)17-18(27-20(26)24-25-21(27)30-13-16(23)28)15-9-5-4-8-14(15)12-22(17)10-6-3-7-11-22/h4-5,8-9H,2-3,6-7,10-13H2,1H3,(H2,23,28)InChIKey
KWYCFFSUOLPFHF-UHFFFAOYSA-NSynonyms
2((4ethyl5oxo57dihydro4Hspiro(benzo(h)(124)triazolo(43a)quinazoline61cyclohexan)1yl)sulfanyl)acetamide
2((4ethyl5oxo57dihydro4Hspiro(benzo(h)(124)triazolo(43a)quinazoline61cyclohexan)1yl)thio)acetamide
CCN1C(=O)C2=C(C3=CC=CC=C3CC24CCCCC4)N5C1=NN=C5SCC(=O)N
InChI=1SC22H25N5O2Sc122619(29)1718(2720(26)242521(27)301316(23)28)15954814(15)1222(17)106371122h4589H23671013H21H3(H22328)
MFCD02241787
ZINC000000779498
ZINC779498
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