Vitas-M small molecule compound
(2Z)-3-(3-methoxy-4-methylphenyl)-2-[(5-methyl-4H-1,2,4-triazol-3-yl)sulfanyl]prop-2-enoic acid
Catalog ID
STL505921
SMILES COc1cc(ccc1C)/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 C14H15N3O3S MW 305.36 g/mol Purity >90% as per NMR
InChI
InChI=1S/C14H15N3O3S/c1-8-4-5-10(6-11(8)20-3)7-12(13(18)19)21-14-15-9(2)16-17-14/h4-7H,1-3H3,(H,18,19)(H,15,16,17)/b12-7-InChIKey
CEODUUXFBIGCDA-GHXNOFRVSA-NSynonyms
841206-87-9(~(Z))3(3methoxy4methylphenyl)2((5methyl1~(H)124triazol3yl)sulfanyl)prop2enoicacid
(2Z)3(3methoxy4methylphenyl)2((5methyl4H124triazol3yl)sulfanyl)prop2enoicacid
(Z)3(3methoxy4methylphenyl)2((5methyl4H124triazol3yl)thio)acrylicacid
841206879
932972
COc1cc(ccc1C)C=C(C(=O)O)Sc1nnc((nH)1)C
MFCD04011224
ZINC000009242615
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