Vitas-M small molecule compound
2-[({5-[(1,3-benzodioxol-5-yloxy)methyl]-4-ethyl-4H-1,2,4-triazol-3-yl}sulfanyl)methyl]-1H-benzimidazole
Catalog ID
STK262157
SMILES CCn1c(SCc2nc3c([nH]2)cccc3)nnc1COc1ccc2c(c1)OCO2
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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 C20H19N5O3S MW 409.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H19N5O3S/c1-2-25-19(10-26-13-7-8-16-17(9-13)28-12-27-16)23-24-20(25)29-11-18-21-14-5-3-4-6-15(14)22-18/h3-9H,2,10-12H2,1H3,(H,21,22)InChIKey
YLUSITUVEOGZDR-UHFFFAOYSA-NSynonyms
2(((5((13benzodioxol5yloxy)methyl)4ethyl4H124triazol3yl)sulfanyl)methyl)1Hbenzimidazole
2((5(13benzodioxol5yloxymethyl)4ethyl124triazol3yl)sulfanylmethyl)1Hbenzimidazole
5((5(BENZIMIDAZOL2YLMETHYLTHIO)4ETHYL124TRIAZOL3YL)METHOXY)2HBENZO(D)13DIOXOLENE
CCN1C(=NN=C1SCC2=NC3=CC=CC=C3N2)COC4=CC5=C(C=C4)OCO5
CCn1c(SCc2nc3c((nH)2)cccc3)nnc1COc1ccc2c(c1)OCO2
InChI=1SC20H19N5O3Sc122519(102613781617(913)28122716)232420(25)2911182114534615(14)2218h39H21012H21H3(H2122)
MFCD08545693
ZINC000009356330
ZINC09356330
ZINC9356330
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