Vitas-M small molecule compound
1-(3,4-dimethoxyphenyl)-2-{[5-(2-fluorophenyl)-4-(prop-2-en-1-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}ethanone
Catalog ID
STK219406
SMILES C=CCn1c(SCC(=O)c2ccc(c(c2)OC)OC)nnc1c1ccccc1F
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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 C21H20FN3O3S MW 413.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H20FN3O3S/c1-4-11-25-20(15-7-5-6-8-16(15)22)23-24-21(25)29-13-17(26)14-9-10-18(27-2)19(12-14)28-3/h4-10,12H,1,11,13H2,2-3H3InChIKey
DHERYVZCHRWEOX-UHFFFAOYSA-NSynonyms
1(34DIMETHOXYPHENYL)2((5(2FLUOROPHENYL)4(PROP2EN1YL)4H124TRIAZOL3YL)SULFANYL)ETHANONE
1(34DIMETHOXYPHENYL)2((5(2FLUOROPHENYL)4PROP2ENYL124TRIAZOL3YL)SULFANYL)ETHANONE
2(4ALLYL5(2FLUOROPHENYL)4H(124)TRIAZOL3YLSULFANYL)1(34DIMETHOXYPHENYL)ETHANONE
COC1=C(C=C(C=C1)C(=O)CSC2=NN=C(N2CC=C)C3=CC=CC=C3F)OC
InChI=1SC21H20FN3O3Sc14112520(15756816(15)22)232421(25)291317(26)1491018(272)19(1214)283h41012H11113H223H3
MFCD07401730
ZINC000004814853
ZINC04814853
ZINC4814853
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