Vitas-M small molecule compound
(6E)-5-imino-6-(3-methoxy-4-{2-[2-methoxy-4-(prop-2-en-1-yl)phenoxy]ethoxy}benzylidene)-2-(propan-2-yl)-5,6-dihydro-7H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one
Catalog ID
STK005754
SMILES C=CCc1ccc(c(c1)OC)OCCOc1ccc(cc1OC)/C=C\1/C(=O)N=c2n(C1=N)nc(s2)C(C)C
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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 C28H30N4O5S MW 534.64 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H30N4O5S/c1-6-7-18-8-10-21(23(15-18)34-4)36-12-13-37-22-11-9-19(16-24(22)35-5)14-20-25(29)32-28(30-26(20)33)38-27(31-32)17(2)3/h6,8-11,14-17,29H,1,7,12-13H2,2-5H3/b20-14+,29-25+InChIKey
RQDMGNNXBFXUQH-RMCDENJMSA-NSynonyms
(6E)5imino6(3methoxy4(2(2methoxy4(prop2en1yl)phenoxy)ethoxy)benzylidene)2(propan2yl)56dihydro7H(134)thiadiazolo(32a)pyrimidin7one
(E)6(4(2(4allyl2methoxyphenoxy)ethoxy)3methoxybenzylidene)5imino2isopropyl5H(134)thiadiazolo(32a)pyrimidin7(6H)one
C=CCc1ccc(c(c1)OC)OCCOc1ccc(cc1OC)C=C1C(=O)N=c2n(C1=N)nc(s2)C(C)C
MFCD02238791
STK005754
ZINC000100267838
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