Vitas-M small molecule compound
1-(4-methoxyphenyl)-2-{[4-(prop-2-en-1-yl)-5-(pyridin-4-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}ethanone
Catalog ID
STK877925
SMILES COc1ccc(cc1)C(=O)CSc1nnc(n1CC=C)c1ccncc1
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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 C19H18N4O2S MW 366.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H18N4O2S/c1-3-12-23-18(15-8-10-20-11-9-15)21-22-19(23)26-13-17(24)14-4-6-16(25-2)7-5-14/h3-11H,1,12-13H2,2H3InChIKey
NJKGEZWWZVSXRY-UHFFFAOYSA-NSynonyms
433699-95-71(4methoxyphenyl)2((4(prop2en1yl)5(pyridin4yl)4H124triazol3yl)sulfanyl)ethanone
1(4METHOXYPHENYL)2((4PROP2ENYL5PYRIDIN4YL124TRIAZOL3YL)SULFANYL)ETHANONE
2((4allyl5(pyridin4yl)4H124triazol3yl)thio)1(4methoxyphenyl)ethanone
433699957
COC1=CC=C(C=C1)C(=O)CSC2=NN=C(N2CC=C)C3=CC=NC=C3
InChI=1SC19H18N4O2Sc13122318(158102011915)212219(23)261317(24)144616(252)7514h311H11213H22H3
MFCD03050187
ZINC000000778531
ZINC00778531
ZINC778531
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