Vitas-M small molecule compound
(6E)-6-({1-[2-(2,5-dimethylphenoxy)ethyl]-1H-indol-3-yl}methylidene)-5-imino-2-propyl-5,6-dihydro-7H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one
Catalog ID
STK050752
SMILES CCCc1nn2c(=NC(=O)/C(=C/c3cn(c4c3cccc4)CCOc3cc(C)ccc3C)/C2=N)s1
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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 C27H27N5O2S MW 485.61 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H27N5O2S/c1-4-7-24-30-32-25(28)21(26(33)29-27(32)35-24)15-19-16-31(22-9-6-5-8-20(19)22)12-13-34-23-14-17(2)10-11-18(23)3/h5-6,8-11,14-16,28H,4,7,12-13H2,1-3H3/b21-15+,28-25-InChIKey
RZHMRTVYCTZPJQ-ANSVGLJFSA-NSynonyms
(6E)6((1(2(25dimethylphenoxy)ethyl)1Hindol3yl)methylidene)5imino2propyl56dihydro7H(134)thiadiazolo(32a)pyrimidin7one
CCCc1nn2c(=NC(=O)C(=Cc3cn(c4c3cccc4)CCOc3cc(C)ccc3C)C2=N)s1
MFCD02952570
STK050752
ZINC000008407953
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