Vitas-M small molecule compound
(6Z)-6-{4-[2-(3,4-dimethylphenoxy)ethoxy]-3-ethoxybenzylidene}-5-imino-2-propyl-5,6-dihydro-7H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one
Catalog ID
STK092296
SMILES CCOc1cc(ccc1OCCOc1ccc(c(c1)C)C)/C=C/1\C(=O)N=c2n(C1=N)nc(s2)CCC
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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 C27H30N4O4S MW 506.63 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H30N4O4S/c1-5-7-24-30-31-25(28)21(26(32)29-27(31)36-24)15-19-9-11-22(23(16-19)33-6-2)35-13-12-34-20-10-8-17(3)18(4)14-20/h8-11,14-16,28H,5-7,12-13H2,1-4H3/b21-15-,28-25-InChIKey
RELJRGZUQLPLHV-ZAJVCVOBSA-NSynonyms
(6Z)6(4(2(34dimethylphenoxy)ethoxy)3ethoxybenzylidene)5imino2propyl56dihydro7H(134)thiadiazolo(32a)pyrimidin7one
CCOc1cc(ccc1OCCOc1ccc(c(c1)C)C)C=C1C(=O)N=c2n(C1=N)nc(s2)CCC
MFCD02118472
STK092296
ZINC000013894907
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