Vitas-M small molecule compound
4-ethyl-3-(4,5,6,7-tetrahydro-1-benzothiophen-3-yl)-5-{[3-(trifluoromethyl)benzyl]sulfanyl}-4H-1,2,4-triazole
Catalog ID
STK467844
SMILES CCn1c(nnc1c1csc2c1CCCC2)SCc1cccc(c1)C(F)(F)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 C20H20F3N3S2 MW 423.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H20F3N3S2/c1-2-26-18(16-12-27-17-9-4-3-8-15(16)17)24-25-19(26)28-11-13-6-5-7-14(10-13)20(21,22)23/h5-7,10,12H,2-4,8-9,11H2,1H3InChIKey
KVMVSJVZIKGIHL-UHFFFAOYSA-NSynonyms
4ethyl3(4567tetrahydro1benzothiophen3yl)5((3(trifluoromethyl)benzyl)sulfanyl)4H124triazole
4ethyl3(4567tetrahydro1benzothiophen3yl)5((3(trifluoromethyl)phenyl)methylsulfanyl)124triazole
CCN1C(=NN=C1SCC2=CC(=CC=C2)C(F)(F)F)C3=CSC4=C3CCCC4
InChI=1SC20H20F3N3S2c122618(16122717943815(16)17)242519(26)28111365714(1013)20(2122)23h571012H248911H21H3
MFCD07118584
ZINC000017093631
ZINC17093631
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