Vitas-M small molecule compound
(6E)-2-ethyl-5-imino-6-[4-(naphthalen-1-ylmethoxy)benzylidene]-5,6-dihydro-7H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one
Catalog ID
STK063547
SMILES CCc1nn2c(=NC(=O)/C(=C/c3ccc(cc3)OCc3cccc4c3cccc4)/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 C25H20N4O2S MW 440.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H20N4O2S/c1-2-22-28-29-23(26)21(24(30)27-25(29)32-22)14-16-10-12-19(13-11-16)31-15-18-8-5-7-17-6-3-4-9-20(17)18/h3-14,26H,2,15H2,1H3/b21-14+,26-23+InChIKey
PETJIQBFAWFNIP-ZXOKNOEDSA-NSynonyms
(6E)2ethyl5imino6(4(naphthalen1ylmethoxy)benzylidene)56dihydro7H(134)thiadiazolo(32a)pyrimidin7one
(Z)2ethyl5imino6(4(naphthalen1ylmethoxy)benzylidene)5H(134)thiadiazolo(32a)pyrimidin7(6H)one
CCc1nn2c(=NC(=O)C(=Cc3ccc(cc3)OCc3cccc4c3cccc4)C2=N)s1
MFCD03183243
STK063547
ZINC000013897260
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