Vitas-M small molecule compound
(6Z)-5-imino-6-(3-methoxy-4-{2-[2-(prop-2-en-1-yl)phenoxy]ethoxy}benzylidene)-2-(2-methylpropyl)-5,6-dihydro-7H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one
Catalog ID
STK085014
SMILES C=CCc1ccccc1OCCOc1ccc(cc1OC)/C=C/1\C(=O)N=c2n(C1=N)nc(s2)CC(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 C28H30N4O4S MW 518.64 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H30N4O4S/c1-5-8-20-9-6-7-10-22(20)35-13-14-36-23-12-11-19(17-24(23)34-4)16-21-26(29)32-28(30-27(21)33)37-25(31-32)15-18(2)3/h5-7,9-12,16-18,29H,1,8,13-15H2,2-4H3/b21-16-,29-26-InChIKey
ROYYTKSYCFFEHG-XXDXIKNJSA-NSynonyms
(6Z)5imino6(3methoxy4(2(2(prop2en1yl)phenoxy)ethoxy)benzylidene)2(2methylpropyl)56dihydro7H(134)thiadiazolo(32a)pyrimidin7one
C=CCc1ccccc1OCCOc1ccc(cc1OC)C=C1C(=O)N=c2n(C1=N)nc(s2)CC(C)C
MFCD09960086
STK085014
ZINC000013893808
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