Vitas-M small molecule compound
(6Z)-5-imino-6-(4-{2-[2-methoxy-4-(prop-2-en-1-yl)phenoxy]ethoxy}benzylidene)-2-(trifluoromethyl)-5,6-dihydro-7H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one
Catalog ID
STK038873
SMILES C=CCc1ccc(c(c1)OC)OCCOc1ccc(cc1)/C=C/1\C(=O)N=c2n(C1=N)nc(s2)C(F)(F)F
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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 C25H21F3N4O4S MW 530.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H21F3N4O4S/c1-3-4-15-7-10-19(20(14-15)34-2)36-12-11-35-17-8-5-16(6-9-17)13-18-21(29)32-24(30-22(18)33)37-23(31-32)25(26,27)28/h3,5-10,13-14,29H,1,4,11-12H2,2H3/b18-13-,29-21-InChIKey
JZCLFERVCFNPRO-RGDPRIJWSA-NSynonyms
497942-85-5(6Z)5imino6(4(2(2methoxy4(prop2en1yl)phenoxy)ethoxy)benzylidene)2(trifluoromethyl)56dihydro7H(134)thiadiazolo(32a)pyrimidin7one
(Z)6(4(2(4allyl2methoxyphenoxy)ethoxy)benzylidene)5imino2(trifluoromethyl)5H(134)thiadiazolo(32a)pyrimidin7(6H)one
497942855
C=CCc1ccc(c(c1)OC)OCCOc1ccc(cc1)C=C1C(=O)N=c2n(C1=N)nc(s2)C(F)(F)F
MFCD03301439
STK038873
ZINC000100890854
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