Vitas-M small molecule compound
3-[(4-chlorophenoxy)methyl]-6-[(E)-2-(thiophen-2-yl)ethenyl][1,2,4]triazolo[3,4-b][1,3,4]thiadiazole
Catalog ID
STK951244
SMILES Clc1ccc(cc1)OCc1nnc2n1nc(s2)/C=C/c1cccs1
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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 C16H11ClN4OS2 MW 374.87 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H11ClN4OS2/c17-11-3-5-12(6-4-11)22-10-14-18-19-16-21(14)20-15(24-16)8-7-13-2-1-9-23-13/h1-9H,10H2/b8-7+InChIKey
YBXLGCKJOJAPCI-BQYQJAHWSA-NSynonyms
3((4chlorophenoxy)methyl)6((E)2(thiophen2yl)ethenyl)(124)triazolo(34b)(134)thiadiazole
3((4CHLOROPHENOXY)METHYL)6((E)2THIOPHEN2YLETHENYL)(124)TRIAZOLO(34B)(134)THIADIAZOLE
C1=CSC(=C1)C=CC2=NN3C(=NN=C3S2)COC4=CC=C(C=C4)Cl
Clc1ccc(cc1)OCc1nnc2n1nc(s2)C=Cc1cccs1
InChI=1SC16H11ClN4OS2c17113512(6411)22101418191621(14)2015(2416)87132192313h19H10H2b87+
MFCD07428983
ZINC000005032348
ZINC05032348
ZINC5032348
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