Vitas-M small molecule compound

(5Z)-5-(3,4-diethoxybenzylidene)-2-[4-(prop-2-en-1-yloxy)phenyl][1,3]thiazolo[3,2-b][1,2,4]triazol-6(5H)-one

Catalog ID
STK817869
SMILES C=CCOc1ccc(cc1)c1nc2n(n1)c(=O)/c(=C/c1ccc(c(c1)OCC)OCC)/s2

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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 C24H23N3O4S MW 449.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H23N3O4S/c1-4-13-31-18-10-8-17(9-11-18)22-25-24-27(26-22)23(28)21(32-24)15-16-7-12-19(29-5-2)20(14-16)30-6-3/h4,7-12,14-15H,1,5-6,13H2,2-3H3/b21-15-
InChIKey
CHQJYCRMHHHJHC-QNGOZBTKSA-N
Synonyms

(5Z)5((34DIETHOXYPHENYL)METHYLIDENE)2(4PROP2ENOXYPHENYL)(13)THIAZOLO(32B)(124)TRIAZOL6ONE
(5Z)5(34diethoxybenzylidene)2(4(prop2en1yloxy)phenyl)(13)thiazolo(32b)(124)triazol6(5H)one
C=CCOc1ccc(cc1)c1nc2n(n1)c(=O)c(=Cc1ccc(c(c1)OCC)OCC)s2
CCOC1=C(C=C(C=C1)C=C2C(=O)N3C(=NC(=N3)C4=CC=C(C=C4)OCC=C)S2)OCC
InChI=1SC24H23N3O4Sc1413311810817(91118)22252427(2622)23(28)21(3224)151671219(2952)20(1416)3063h47121415H15613H223H3b2115
MFCD04447616
ZINC000016736615
ZINC16736615

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Available files

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