Vitas-M small molecule compound
2-{[5-(3,4-dimethoxyphenyl)-4-(prop-2-en-1-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}-1-(3-methoxyphenyl)ethanone
Catalog ID
STK267122
SMILES C=CCn1c(SCC(=O)c2cccc(c2)OC)nnc1c1ccc(c(c1)OC)OC
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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 C22H23N3O4S MW 425.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H23N3O4S/c1-5-11-25-21(16-9-10-19(28-3)20(13-16)29-4)23-24-22(25)30-14-18(26)15-7-6-8-17(12-15)27-2/h5-10,12-13H,1,11,14H2,2-4H3InChIKey
GESBGBQWLWZGJM-UHFFFAOYSA-NSynonyms
2((5(34DIMETHOXYPHENYL)4(PROP2EN1YL)4H124TRIAZOL3YL)SULFANYL)1(3METHOXYPHENYL)ETHANONE
2((5(34dimethoxyphenyl)4prop2enyl124triazol3yl)sulfanyl)1(3methoxyphenyl)ethanone
2(4ALLYL5(34DIMETHOXYPHENYL)4H(124)TRIAZOL3YLSULFANYL)1(3METHOXYPHENYL)ETHANONE
COC1=C(C=C(C=C1)C2=NN=C(N2CC=C)SCC(=O)C3=CC(=CC=C3)OC)OC
InChI=1SC22H23N3O4Sc15112521(1691019(283)20(1316)294)232422(25)301418(26)1576817(1215)272h5101213H11114H224H3
MFCD09267771
ZINC000009582650
ZINC09582650
ZINC9582650
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