Vitas-M small molecule compound
1-(3-methoxyphenyl)-2-{[4-phenyl-5-(pyridin-3-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}ethanone
Catalog ID
STK991848
SMILES COc1cccc(c1)C(=O)CSc1nnc(n1c1ccccc1)c1cccnc1
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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 C22H18N4O2S MW 402.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H18N4O2S/c1-28-19-11-5-7-16(13-19)20(27)15-29-22-25-24-21(17-8-6-12-23-14-17)26(22)18-9-3-2-4-10-18/h2-14H,15H2,1H3InChIKey
NNUPMNBMEAXYJB-UHFFFAOYSA-NSynonyms
847471-98-11(3methoxyphenyl)2((4phenyl5(pyridin3yl)4H124triazol3yl)sulfanyl)ethanone
1(3methoxyphenyl)2((4phenyl5(pyridin3yl)4H124triazol3yl)thio)ethanone
1(3METHOXYPHENYL)2((4PHENYL5PYRIDIN3YL124TRIAZOL3YL)SULFANYL)ETHANONE
847471981
COC1=CC=CC(=C1)C(=O)CSC2=NN=C(N2C3=CC=CC=C3)C4=CN=CC=C4
InChI=1SC22H18N4O2Sc12819115716(1319)20(27)152922252421(178612231417)26(22)1893241018h214H15H21H3
MFCD03611903
ZINC000005478658
ZINC05478658
ZINC5478658
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