Vitas-M small molecule compound
(5Z)-5-(2-propoxybenzylidene)-2-[(E)-2-(thiophen-2-yl)ethenyl][1,3]thiazolo[3,2-b][1,2,4]triazol-6(5H)-one
Catalog ID
STK904517
SMILES CCCOc1ccccc1/C=c/1\sc2n(c1=O)nc(n2)/C=C/c1cccs1
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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 C20H17N3O2S2 MW 395.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H17N3O2S2/c1-2-11-25-16-8-4-3-6-14(16)13-17-19(24)23-20(27-17)21-18(22-23)10-9-15-7-5-12-26-15/h3-10,12-13H,2,11H2,1H3/b10-9+,17-13-InChIKey
IZSFAFDAHGBSHT-GIYAWHNBSA-NSynonyms
(5Z)5((2propoxyphenyl)methylidene)2((E)2thiophen2ylethenyl)(13)thiazolo(32b)(124)triazol6one
(5Z)5(2propoxybenzylidene)2((E)2(thiophen2yl)ethenyl)(13)thiazolo(32b)(124)triazol6(5H)one
CCCOC1=CC=CC=C1C=C2C(=O)N3C(=NC(=N3)C=CC4=CC=CS4)S2
CCCOc1ccccc1C=c1sc2n(c1=O)nc(n2)C=Cc1cccs1
InChI=1SC20H17N3O2S2c12112516843614(16)131719(24)2320(2717)2118(2223)1091575122615h3101213H211H21H3b109+1713
MFCD18076092
ZINC000027022065
ZINC27022065
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