Vitas-M small molecule compound
(6Z)-6-{4-[(2-fluorobenzyl)oxy]-3-methoxybenzylidene}-5-imino-2-[2-(morpholin-4-yl)-2-oxoethyl]-5,6-dihydro-7H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one
Catalog ID
STL241939
SMILES COc1cc(ccc1OCc1ccccc1F)/C=C/1\C(=O)N=c2n(C1=N)nc(s2)CC(=O)N1CCOCC1
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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 C26H24FN5O5S MW 537.57 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H24FN5O5S/c1-35-21-13-16(6-7-20(21)37-15-17-4-2-3-5-19(17)27)12-18-24(28)32-26(29-25(18)34)38-22(30-32)14-23(33)31-8-10-36-11-9-31/h2-7,12-13,28H,8-11,14-15H2,1H3/b18-12-,28-24-InChIKey
PUHGTSUXXGRDFZ-BEEJUBGZSA-NSynonyms
847368-25-6(6Z)6(4((2fluorobenzyl)oxy)3methoxybenzylidene)5imino2(2(morpholin4yl)2oxoethyl)56dihydro7H(134)thiadiazolo(32a)pyrimidin7one
(Z)6(4((2fluorobenzyl)oxy)3methoxybenzylidene)5imino2(2morpholino2oxoethyl)5H(134)thiadiazolo(32a)pyrimidin7(6H)one
847368256
COc1cc(ccc1OCc1ccccc1F)C=C1C(=O)N=c2n(C1=N)nc(s2)CC(=O)N1CCOCC1
MFCD04180884
ZINC000101141731
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