Vitas-M small molecule compound
N-[5-(3-ethyl[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl)-2-methylphenyl]-2-(2-nitrophenoxy)acetamide
Catalog ID
STK398740
SMILES CCc1nnc2n1nc(s2)c1ccc(c(c1)NC(=O)COc1ccccc1[N+](=O)[O-])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 C20H18N6O4S MW 438.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H18N6O4S/c1-3-17-22-23-20-25(17)24-19(31-20)13-9-8-12(2)14(10-13)21-18(27)11-30-16-7-5-4-6-15(16)26(28)29/h4-10H,3,11H2,1-2H3,(H,21,27)InChIKey
BYGUUPQKYXZVKT-UHFFFAOYSA-NSynonyms
CCC1=NN=C2N1N=C(S2)C3=CC(=C(C=C3)C)NC(=O)COC4=CC=CC=C4(N+)(=O)(O)
CCc1nnc2n1nc(s2)c1ccc(c(c1)NC(=O)COc1ccccc1(N+)(=O)(O))C
InChI=1SC20H18N6O4Sc131722232025(17)2419(3120)139812(2)14(1013)2118(27)113016754615(16)26(28)29h410H311H212H3(H2127)
MFCD05829724
N(5(3ethyl(124)triazolo(34b)(134)thiadiazol6yl)2methylphenyl)2(2nitrophenoxy)acetamide
ZINC000002875375
ZINC02875375
ZINC2875375
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