Vitas-M small molecule compound
(6Z)-6-[4-(benzyloxy)-3-methoxybenzylidene]-5-imino-2-[2-oxo-2-(pyrrolidin-1-yl)ethyl]-5,6-dihydro-7H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one
Catalog ID
STK558242
SMILES COc1cc(ccc1OCc1ccccc1)/C=C/1\C(=O)N=c2n(C1=N)nc(s2)CC(=O)N1CCCC1
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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 C26H25N5O4S MW 503.58 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H25N5O4S/c1-34-21-14-18(9-10-20(21)35-16-17-7-3-2-4-8-17)13-19-24(27)31-26(28-25(19)33)36-22(29-31)15-23(32)30-11-5-6-12-30/h2-4,7-10,13-14,27H,5-6,11-12,15-16H2,1H3/b19-13-,27-24-InChIKey
FHHDTELDVCYBJK-BZYINNAZSA-NSynonyms
586982-78-7(6Z)6(4(benzyloxy)3methoxybenzylidene)5imino2(2oxo2(pyrrolidin1yl)ethyl)56dihydro7H(134)thiadiazolo(32a)pyrimidin7one
(Z)6(4(benzyloxy)3methoxybenzylidene)5imino2(2oxo2(pyrrolidin1yl)ethyl)5H(134)thiadiazolo(32a)pyrimidin7(6H)one
586982787
COc1cc(ccc1OCc1ccccc1)C=C1C(=O)N=c2n(C1=N)nc(s2)CC(=O)N1CCCC1
MFCD04030927
ZINC000009190584
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