Vitas-M small molecule compound
2-(5-{[2-(1,3-benzodioxol-5-ylamino)-2-oxoethyl]sulfanyl}-4-methyl-4H-1,2,4-triazol-3-yl)-N-phenylacetamide
Catalog ID
STK230334
SMILES O=C(Nc1ccc2c(c1)OCO2)CSc1nnc(n1C)CC(=O)Nc1ccccc1
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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 C20H19N5O4S MW 425.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H19N5O4S/c1-25-17(10-18(26)21-13-5-3-2-4-6-13)23-24-20(25)30-11-19(27)22-14-7-8-15-16(9-14)29-12-28-15/h2-9H,10-12H2,1H3,(H,21,26)(H,22,27)InChIKey
CTEHYDTYRHVDAB-UHFFFAOYSA-NSynonyms
2(5((2(13BENZODIOXOL5YLAMINO)2OXOETHYL)SULFANYL)4METHYL4H124TRIAZOL3YL)NPHENYLACETAMIDE
2(5(2(13BENZODIOXOL5YLAMINO)2OXOETHYL)SULFANYL4METHYL124TRIAZOL3YL)NPHENYLACETAMIDE
CN1C(=NN=C1SCC(=O)NC2=CC3=C(C=C2)OCO3)CC(=O)NC4=CC=CC=C4
InChI=1SC20H19N5O4Sc12517(1018(26)21135324613)232420(25)301119(27)2214781516(914)29122815h29H1012H21H3(H2126)(H2227)
MFCD07790375
ZINC000009263225
ZINC09263225
ZINC9263225
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