Vitas-M small molecule compound
(6Z)-6-({1-[2-(4-bromophenoxy)ethyl]-1H-pyrrol-2-yl}methylidene)-5-imino-2-propyl-5,6-dihydro-7H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one
Catalog ID
STK016759
SMILES CCCc1nn2c(=NC(=O)/C(=C\c3cccn3CCOc3ccc(cc3)Br)/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 C21H20BrN5O2S MW 486.39 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H20BrN5O2S/c1-2-4-18-25-27-19(23)17(20(28)24-21(27)30-18)13-15-5-3-10-26(15)11-12-29-16-8-6-14(22)7-9-16/h3,5-10,13,23H,2,4,11-12H2,1H3/b17-13-,23-19-InChIKey
YDELABHUDZOCED-NWNLLFAKSA-NSynonyms
(6Z)6((1(2(4bromophenoxy)ethyl)1Hpyrrol2yl)methylidene)5imino2propyl56dihydro7H(134)thiadiazolo(32a)pyrimidin7one
CCCc1nn2c(=NC(=O)C(=Cc3cccn3CCOc3ccc(cc3)Br)C2=N)s1
MFCD08049653
STK016759
ZINC000030819125
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