Vitas-M small molecule compound
(6E)-5-imino-6-(4-methoxybenzylidene)-2-[2-oxo-2-(piperidin-1-yl)ethyl]-5,6-dihydro-7H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one
Catalog ID
STK627751
SMILES COc1ccc(cc1)/C=C\1/C(=O)N=c2n(C1=N)nc(s2)CC(=O)N1CCCCC1
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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 C20H21N5O3S MW 411.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H21N5O3S/c1-28-14-7-5-13(6-8-14)11-15-18(21)25-20(22-19(15)27)29-16(23-25)12-17(26)24-9-3-2-4-10-24/h5-8,11,21H,2-4,9-10,12H2,1H3/b15-11+,21-18-InChIKey
KSWLGYANYAPQKQ-FMOFIACUSA-NSynonyms
845900-29-0(6E)5imino6(4methoxybenzylidene)2(2oxo2(piperidin1yl)ethyl)56dihydro7H(134)thiadiazolo(32a)pyrimidin7one
(E)5imino6(4methoxybenzylidene)2(2oxo2(piperidin1yl)ethyl)5H(134)thiadiazolo(32a)pyrimidin7(6H)one
845900290
COc1ccc(cc1)C=C1C(=O)N=c2n(C1=N)nc(s2)CC(=O)N1CCCCC1
MFCD04172817
ZINC000005191481
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