Vitas-M small molecule compound
(5Z)-2-(2,3-dihydro-1,4-benzodioxin-2-yl)-5-[4-(methylsulfanyl)benzylidene][1,3]thiazolo[3,2-b][1,2,4]triazol-6(5H)-one
Catalog ID
STK515582
SMILES CSc1ccc(cc1)/C=c/1\sc2n(c1=O)nc(n2)C1COc2c(O1)cccc2
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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 C20H15N3O3S2 MW 409.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H15N3O3S2/c1-27-13-8-6-12(7-9-13)10-17-19(24)23-20(28-17)21-18(22-23)16-11-25-14-4-2-3-5-15(14)26-16/h2-10,16H,11H2,1H3/b17-10-InChIKey
NPOAYPDOMINIRG-YVLHZVERSA-NSynonyms
(5Z)2(23dihydro14benzodioxin2yl)5(4(methylsulfanyl)benzylidene)(13)thiazolo(32b)(124)triazol6(5H)one
(5Z)2(23DIHYDRO14BENZODIOXIN3YL)5((4METHYLSULFANYLPHENYL)METHYLIDENE)(13)THIAZOLO(32B)(124)TRIAZOL6ONE
CSC1=CC=C(C=C1)C=C2C(=O)N3C(=NC(=N3)C4COC5=CC=CC=C5O4)S2
CSc1ccc(cc1)C=c1sc2n(c1=O)nc(n2)C1COc2c(O1)cccc2
InChI=1SC20H15N3O3S2c127138612(7913)101719(24)2320(2817)2118(2223)16112514423515(14)2616h21016H11H21H3b1710
MFCD03533468
ZINC000016741944
ZINC000016741945
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