Vitas-M small molecule compound
(6Z)-2-(benzylsulfanyl)-6-{3-ethoxy-4-[2-(3-methoxyphenoxy)ethoxy]benzylidene}-5-imino-5,6-dihydro-7H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one
Catalog ID
STK077488
SMILES CCOc1cc(ccc1OCCOc1cccc(c1)OC)/C=C/1\C(=O)N=c2n(C1=N)nc(s2)SCc1ccccc1
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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 C30H28N4O5S2 MW 588.71 g/mol Purity >90% as per NMR
InChI
InChI=1S/C30H28N4O5S2/c1-3-37-26-17-21(12-13-25(26)39-15-14-38-23-11-7-10-22(18-23)36-2)16-24-27(31)34-29(32-28(24)35)41-30(33-34)40-19-20-8-5-4-6-9-20/h4-13,16-18,31H,3,14-15,19H2,1-2H3/b24-16-,31-27-InChIKey
OYUXPHUDOJNCIQ-FOKVZDHXSA-NSynonyms
(6Z)2(benzylsulfanyl)6(3ethoxy4(2(3methoxyphenoxy)ethoxy)benzylidene)5imino56dihydro7H(134)thiadiazolo(32a)pyrimidin7one
CCOc1cc(ccc1OCCOc1cccc(c1)OC)C=C1C(=O)N=c2n(C1=N)nc(s2)SCc1ccccc1
MFCD03566951
STK077488
ZINC000097959031
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