Vitas-M small molecule compound
3-chloro-N-[5-(3-ethyl[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl)-2-methylphenyl]-1-benzothiophene-2-carboxamide
Catalog ID
STK398738
SMILES CCc1nnc2n1nc(s2)c1ccc(c(c1)NC(=O)c1sc2c(c1Cl)cccc2)C
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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 C21H16ClN5OS2 MW 453.98 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H16ClN5OS2/c1-3-16-24-25-21-27(16)26-20(30-21)12-9-8-11(2)14(10-12)23-19(28)18-17(22)13-6-4-5-7-15(13)29-18/h4-10H,3H2,1-2H3,(H,23,28)InChIKey
MUYWGYLALFTRAY-UHFFFAOYSA-NSynonyms
3chloroN(5(3ethyl(124)triazolo(34b)(134)thiadiazol6yl)2methylphenyl)1benzothiophene2carboxamide
CCC1=NN=C2N1N=C(S2)C3=CC(=C(C=C3)C)NC(=O)C4=C(C5=CC=CC=C5S4)Cl
InChI=1SC21H16ClN5OS2c131624252127(16)2620(3021)129811(2)14(1012)2319(28)1817(22)13645715(13)2918h410H3H212H3(H2328)
MFCD05829719
ZINC000013148167
ZINC13148167
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