Vitas-M small molecule compound
3-({[2-(1,3-benzodioxol-5-yl)-1,3-thiazol-4-yl]methyl}sulfanyl)-4-ethyl-5-phenyl-4H-1,2,4-triazole
Catalog ID
STK467764
SMILES CCn1c(SCc2csc(n2)c2ccc3c(c2)OCO3)nnc1c1ccccc1
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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 C21H18N4O2S2 MW 422.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H18N4O2S2/c1-2-25-19(14-6-4-3-5-7-14)23-24-21(25)29-12-16-11-28-20(22-16)15-8-9-17-18(10-15)27-13-26-17/h3-11H,2,12-13H2,1H3InChIKey
IMUKDNNOOZOCJB-UHFFFAOYSA-NSynonyms
2(13benzodioxol5yl)4((4ethyl5phenyl124triazol3yl)sulfanylmethyl)13thiazole
3(((2(13benzodioxol5yl)13thiazol4yl)methyl)sulfanyl)4ethyl5phenyl4H124triazole
3((2(2HBENZO(34D)13DIOXOLAN5YL)(13THIAZOL4YL))METHYLTHIO)4ETHYL5PHENYL124TRIAZOLE
CCN1C(=NN=C1SCC2=CSC(=N2)C3=CC4=C(C=C3)OCO4)C5=CC=CC=C5
InChI=1SC21H18N4O2S2c122519(146435714)232421(25)291216112820(2216)15891718(1015)27132617h311H21213H21H3
MFCD06078211
ZINC000017093192
ZINC17093192
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