Vitas-M small molecule compound
2-{[4-(furan-2-ylmethyl)-5-(3-methoxyphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-1-phenylethanone
Catalog ID
STK596518
SMILES COc1cccc(c1)c1nnc(n1Cc1ccco1)SCC(=O)c1ccccc1
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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 C22H19N3O3S MW 405.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H19N3O3S/c1-27-18-10-5-9-17(13-18)21-23-24-22(25(21)14-19-11-6-12-28-19)29-15-20(26)16-7-3-2-4-8-16/h2-13H,14-15H2,1H3InChIKey
MBLMPILTSCUJPS-UHFFFAOYSA-NSynonyms
849031-21-62((4(FURAN2YLMETHYL)5(3METHOXYPHENYL)124TRIAZOL3YL)SULFANYL)1PHENYLETHANONE
2((4(furan2ylmethyl)5(3methoxyphenyl)4H124triazol3yl)sulfanyl)1phenylethanone
2((4(furan2ylmethyl)5(3methoxyphenyl)4H124triazol3yl)thio)1phenylethanone
849031216
COC1=CC=CC(=C1)C2=NN=C(N2CC3=CC=CO3)SCC(=O)C4=CC=CC=C4
InChI=1SC22H19N3O3Sc12718105917(1318)21232422(25(21)1419116122819)291520(26)167324816h213H1415H21H3
MFCD05681918
ZINC000002454287
ZINC02454287
ZINC2454287
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