Vitas-M small molecule compound
(6Z)-6-{3-bromo-5-ethoxy-4-[2-(4-methylphenoxy)ethoxy]benzylidene}-2-ethyl-5-imino-5,6-dihydro-7H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one
Catalog ID
STK093236
SMILES CCOc1cc(cc(c1OCCOc1ccc(cc1)C)Br)/C=C/1\C(=O)N=c2n(C1=N)nc(s2)CC
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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 C25H25BrN4O4S MW 557.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H25BrN4O4S/c1-4-21-29-30-23(27)18(24(31)28-25(30)35-21)12-16-13-19(26)22(20(14-16)32-5-2)34-11-10-33-17-8-6-15(3)7-9-17/h6-9,12-14,27H,4-5,10-11H2,1-3H3/b18-12-,27-23-InChIKey
ULQXJQUPYCSYEN-IWVOYHCTSA-NSynonyms
(6Z)6(3bromo5ethoxy4(2(4methylphenoxy)ethoxy)benzylidene)2ethyl5imino56dihydro7H(134)thiadiazolo(32a)pyrimidin7one
CCOc1cc(cc(c1OCCOc1ccc(cc1)C)Br)C=C1C(=O)N=c2n(C1=N)nc(s2)CC
MFCD02109820
STK093236
ZINC000100642087
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