Vitas-M small molecule compound
(6E)-5-imino-6-(4-methoxybenzylidene)-2-(pentan-3-yl)-5,6-dihydro-7H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one
Catalog ID
STK712779
SMILES CCC(c1nn2c(=NC(=O)/C(=C/c3ccc(cc3)OC)/C2=N)s1)CC
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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 C18H20N4O2S MW 356.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H20N4O2S/c1-4-12(5-2)17-21-22-15(19)14(16(23)20-18(22)25-17)10-11-6-8-13(24-3)9-7-11/h6-10,12,19H,4-5H2,1-3H3/b14-10+,19-15-InChIKey
GIBJNOVXOLSMTE-SEFMAXKISA-NSynonyms
877794-78-0(6E)5imino6(4methoxybenzylidene)2(pentan3yl)56dihydro7H(134)thiadiazolo(32a)pyrimidin7one
(E)5imino6(4methoxybenzylidene)2(pentan3yl)5H(134)thiadiazolo(32a)pyrimidin7(6H)one
877794780
CCC(c1nn2c(=NC(=O)C(=Cc3ccc(cc3)OC)C2=N)s1)CC
MFCD05702903
ZINC000005573068
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