Vitas-M small molecule compound
(6Z)-6-{4-[(2-chlorobenzyl)oxy]benzylidene}-5-imino-2-propyl-5,6-dihydro-7H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one
Catalog ID
STK836182
SMILES CCCc1nn2c(=NC(=O)/C(=C\c3ccc(cc3)OCc3ccccc3Cl)/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 C22H19ClN4O2S MW 438.94 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H19ClN4O2S/c1-2-5-19-26-27-20(24)17(21(28)25-22(27)30-19)12-14-8-10-16(11-9-14)29-13-15-6-3-4-7-18(15)23/h3-4,6-12,24H,2,5,13H2,1H3/b17-12-,24-20-InChIKey
WHVFNWWSRSNBBI-MAWDPOHQSA-NSynonyms
(6Z)6(4((2chlorobenzyl)oxy)benzylidene)5imino2propyl56dihydro7H(134)thiadiazolo(32a)pyrimidin7one
(Z)6(4((2chlorobenzyl)oxy)benzylidene)5imino2propyl5H(134)thiadiazolo(32a)pyrimidin7(6H)one
CCCc1nn2c(=NC(=O)C(=Cc3ccc(cc3)OCc3ccccc3Cl)C2=N)s1
MFCD02118103
ZINC000009008168
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