Vitas-M small molecule compound
2-{[4-ethyl-5-(3,4,5-trimethoxyphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-1-(4-fluorophenyl)ethanone
Catalog ID
STK807365
SMILES COc1cc(cc(c1OC)OC)c1nnc(n1CC)SCC(=O)c1ccc(cc1)F
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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 C21H22FN3O4S MW 431.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H22FN3O4S/c1-5-25-20(14-10-17(27-2)19(29-4)18(11-14)28-3)23-24-21(25)30-12-16(26)13-6-8-15(22)9-7-13/h6-11H,5,12H2,1-4H3InChIKey
ZBLMEXUSXPIJBI-UHFFFAOYSA-NSynonyms
637320-97-92((4ETHYL5(345TRIMETHOXYPHENYL)124TRIAZOL3YL)SULFANYL)1(4FLUOROPHENYL)ETHANONE
2((4ethyl5(345trimethoxyphenyl)4H124triazol3yl)sulfanyl)1(4fluorophenyl)ethanone
2((4ETHYL5(345TRIMETHOXYPHENYL)4H124TRIAZOL3YL)THIO)1(4FLUOROPHENYL)ETHANONE
2(4ETHYL5(345TRIMETHOXYPHENYL)(124TRIAZOL3YLTHIO))1(4FLUOROPHENYL)ETHAN1ONE
637320979
CCN1C(=NN=C1SCC(=O)C2=CC=C(C=C2)F)C3=CC(=C(C(=C3)OC)OC)OC
InChI=1SC21H22FN3O4Sc152520(141017(272)19(294)18(1114)283)232421(25)301216(26)136815(22)9713h611H512H214H3
MFCD04065551
ZINC000000936555
ZINC00936555
ZINC936555
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