Vitas-M small molecule compound
(6E)-6-[3-ethoxy-4-(2-phenoxyethoxy)benzylidene]-5-imino-2-propyl-5,6-dihydro-7H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one
Catalog ID
STK023370
SMILES CCCc1nn2c(=NC(=O)/C(=C/c3ccc(c(c3)OCC)OCCOc3ccccc3)/C2=N)s1
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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 C25H26N4O4S MW 478.57 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H26N4O4S/c1-3-8-22-28-29-23(26)19(24(30)27-25(29)34-22)15-17-11-12-20(21(16-17)31-4-2)33-14-13-32-18-9-6-5-7-10-18/h5-7,9-12,15-16,26H,3-4,8,13-14H2,1-2H3/b19-15+,26-23+InChIKey
LIZVTQVXITXALB-HPXBAKLKSA-NSynonyms
(6E)6(3ethoxy4(2phenoxyethoxy)benzylidene)5imino2propyl56dihydro7H(134)thiadiazolo(32a)pyrimidin7one
(Z)6(3ethoxy4(2phenoxyethoxy)benzylidene)5imino2propyl5H(134)thiadiazolo(32a)pyrimidin7(6H)one
CCCc1nn2c(=NC(=O)C(=Cc3ccc(c(c3)OCC)OCCOc3ccccc3)C2=N)s1
MFCD03227311
STK023370
ZINC000009112974
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