Vitas-M small molecule compound
1-(3,4-dimethoxyphenyl)-2-{[5-(2-fluorophenyl)-4-(propan-2-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}ethanone
Catalog ID
STK230740
SMILES COc1cc(ccc1OC)C(=O)CSc1nnc(n1C(C)C)c1ccccc1F
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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 C21H22FN3O3S MW 415.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H22FN3O3S/c1-13(2)25-20(15-7-5-6-8-16(15)22)23-24-21(25)29-12-17(26)14-9-10-18(27-3)19(11-14)28-4/h5-11,13H,12H2,1-4H3InChIKey
UKKLRLDDZONXDC-UHFFFAOYSA-NSynonyms
1(34dimethoxyphenyl)2((5(2fluorophenyl)4(propan2yl)4H124triazol3yl)sulfanyl)ethanone
1(34DIMETHOXYPHENYL)2((5(2FLUOROPHENYL)4PROPAN2YL124TRIAZOL3YL)SULFANYL)ETHANONE
CC(C)N1C(=NN=C1SCC(=O)C2=CC(=C(C=C2)OC)OC)C3=CC=CC=C3F
InChI=1SC21H22FN3O3Sc113(2)2520(15756816(15)22)232421(25)291217(26)1491018(273)19(1114)284h51113H12H214H3
MFCD07791513
ZINC000004736141
ZINC04736141
ZINC4736141
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