Vitas-M small molecule compound
(2Z)-3-(2-chlorophenyl)-2-[(5-methyl-4H-1,2,4-triazol-3-yl)sulfanyl]prop-2-enoic acid
Catalog ID
STL505908
SMILES OC(=O)/C(=C/c1ccccc1Cl)/Sc1nnc([nH]1)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 C12H10ClN3O2S MW 295.75 g/mol Purity >90% as per NMR
InChI
InChI=1S/C12H10ClN3O2S/c1-7-14-12(16-15-7)19-10(11(17)18)6-8-4-2-3-5-9(8)13/h2-6H,1H3,(H,17,18)(H,14,15,16)/b10-6-InChIKey
UDDRDTIVMXAUKY-POHAHGRESA-NSynonyms
586993-97-7(~(Z))3(2chlorophenyl)2((5methyl1~(H)124triazol3yl)sulfanyl)prop2enoicacid
(2Z)3(2chlorophenyl)2((5methyl4H124triazol3yl)sulfanyl)prop2enoicacid
(Z)3(2CHLOROPHENYL)2((5METHYL1H124TRIAZOL3YL)SULFANYL)PROP2ENOICACID
(Z)3(2chlorophenyl)2((5methyl4H124triazol3yl)thio)acrylicacid
586993977
7509540
InChI=1SC12H10ClN3O2Sc171412(16157)1910(11(17)18)6842359(8)13h26H1H3(H1718)(H141516)b106
MFCD04032124
OC(=O)C(=Cc1ccccc1Cl)Sc1nnc((nH)1)C
ZINC000005119069
ZINC5119069
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