Vitas-M small molecule compound
3-(3-{[(5-ethyl-4H-1,2,4-triazol-3-yl)sulfanyl]methyl}-1,2,4-oxadiazol-5-yl)-N-(naphthalen-2-yl)propanamide
Catalog ID
STL287565
SMILES CCc1nnc([nH]1)SCc1noc(n1)CCC(=O)Nc1ccc2c(c1)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 C20H20N6O2S MW 408.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H20N6O2S/c1-2-16-23-20(25-24-16)29-12-17-22-19(28-26-17)10-9-18(27)21-15-8-7-13-5-3-4-6-14(13)11-15/h3-8,11H,2,9-10,12H2,1H3,(H,21,27)(H,23,24,25)InChIKey
LJHLGXPYDDVUIL-UHFFFAOYSA-NSynonyms
3(3(((5ethyl4H124triazol3yl)sulfanyl)methyl)124oxadiazol5yl)N(naphthalen2yl)propanamide
3(3((5ethyl1H124triazol3yl)sulfanylmethyl)124oxadiazol5yl)Nnaphthalen2ylpropanamide
CCC1=NC(=NN1)SCC2=NOC(=N2)CCC(=O)NC3=CC4=CC=CC=C4C=C3
CCc1nnc((nH)1)SCc1noc(n1)CCC(=O)Nc1ccc2c(c1)cccc2
InChI=1SC20H20N6O2Sc12162320(252416)2912172219(282617)10918(27)21158713534614(13)1115h3811H291012H21H3(H2127)(H232425)
MFCD15078543
ZINC000033087457
ZINC33087457
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