Vitas-M small molecule compound
(2Z)-3-{4-[(4-chlorobenzyl)oxy]phenyl}-2-[(5-methyl-4H-1,2,4-triazol-3-yl)sulfanyl]prop-2-enoic acid
Catalog ID
STL505139
SMILES Clc1ccc(cc1)COc1ccc(cc1)/C=C(/C(=O)O)\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 C19H16ClN3O3S MW 401.87 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H16ClN3O3S/c1-12-21-19(23-22-12)27-17(18(24)25)10-13-4-8-16(9-5-13)26-11-14-2-6-15(20)7-3-14/h2-10H,11H2,1H3,(H,24,25)(H,21,22,23)/b17-10-InChIKey
YZPAKFDDNVAXMJ-YVLHZVERSA-NSynonyms
573936-18-2(~(Z))3(4((4chlorophenyl)methoxy)phenyl)2((5methyl1~(H)124triazol3yl)sulfanyl)prop2enoicacid
(2Z)3(4((4chlorobenzyl)oxy)phenyl)2((5methyl4H124triazol3yl)sulfanyl)prop2enoicacid
(Z)3(4((4chlorobenzyl)oxy)phenyl)2((5methyl4H124triazol3yl)thio)acrylicacid
1629950
573936182
Clc1ccc(cc1)COc1ccc(cc1)C=C(C(=O)O)Sc1nnc((nH)1)C
MFCD04020100
ZINC000009359893
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