Vitas-M small molecule compound
(6Z)-6-[4-(benzyloxy)-3-ethoxybenzylidene]-2-ethyl-5-imino-5,6-dihydro-7H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one
Catalog ID
STK712052
SMILES CCOc1cc(ccc1OCc1ccccc1)/C=C/1\C(=O)N=c2n(C1=N)nc(s2)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 C23H22N4O3S MW 434.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H22N4O3S/c1-3-20-26-27-21(24)17(22(28)25-23(27)31-20)12-16-10-11-18(19(13-16)29-4-2)30-14-15-8-6-5-7-9-15/h5-13,24H,3-4,14H2,1-2H3/b17-12-,24-21-InChIKey
VWEVMSPTHSDUEN-GXRVDCRFSA-NSynonyms
(6Z)6(4(benzyloxy)3ethoxybenzylidene)2ethyl5imino56dihydro7H(134)thiadiazolo(32a)pyrimidin7one
(Z)6(4(benzyloxy)3ethoxybenzylidene)2ethyl5imino5H(134)thiadiazolo(32a)pyrimidin7(6H)one
CCOc1cc(ccc1OCc1ccccc1)C=C1C(=O)N=c2n(C1=N)nc(s2)CC
MFCD02950894
ZINC000009008236
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