Vitas-M small molecule compound
(6E)-2-(2-cyclohexylethyl)-5-imino-6-(4-methylbenzylidene)-5,6-dihydro-7H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one
Catalog ID
STL225006
SMILES Cc1ccc(cc1)/C=C\1/C(=O)N=c2n(C1=N)nc(s2)CCC1CCCCC1
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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 C21H24N4OS MW 380.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H24N4OS/c1-14-7-9-16(10-8-14)13-17-19(22)25-21(23-20(17)26)27-18(24-25)12-11-15-5-3-2-4-6-15/h7-10,13,15,22H,2-6,11-12H2,1H3/b17-13+,22-19-InChIKey
LVNRNRZXLAFABB-ZRJBHMFGSA-NSynonyms
(6E)2(2cyclohexylethyl)5imino6(4methylbenzylidene)56dihydro7H(134)thiadiazolo(32a)pyrimidin7one
(Z)2(2cyclohexylethyl)5imino6(4methylbenzylidene)5H(134)thiadiazolo(32a)pyrimidin7(6H)one
Cc1ccc(cc1)C=C1C(=O)N=c2n(C1=N)nc(s2)CCC1CCCCC1
MFCD24857989
ZINC000033671615
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