Vitas-M small molecule compound
2-{[2-(pyrrolidin-1-yl)ethyl]sulfanyl}-4-(trifluoromethyl)-6,7,8,9-tetrahydro-5H-cyclohepta[b]pyridine-3-carbonitrile
Catalog ID
STL345849
SMILES N#Cc1c(SCCN2CCCC2)nc2c(c1C(F)(F)F)CCCCC2
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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 C18H22F3N3S MW 369.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H22F3N3S/c19-18(20,21)16-13-6-2-1-3-7-15(13)23-17(14(16)12-22)25-11-10-24-8-4-5-9-24/h1-11H2InChIKey
QSTWVXUOKJCLHV-UHFFFAOYSA-NSynonyms
626221-63-42((2(pyrrolidin1yl)ethyl)sulfanyl)4(trifluoromethyl)6789tetrahydro5Hcyclohepta(b)pyridine3carbonitrile
2((2(pyrrolidin1yl)ethyl)thio)4(trifluoromethyl)6789tetrahydro5Hcyclohepta(b)pyridine3carbonitrile
2(2pyrrolidin1ylethylsulfanyl)4(trifluoromethyl)6789tetrahydro5Hcyclohepta(b)pyridine3carbonitrile
626221634
C1CCC2=C(CC1)N=C(C(=C2C(F)(F)F)C#N)SCCN3CCCC3
InChI=1SC18H22F3N3Sc1918(2021)16136213715(13)2317(14(16)1222)25111024845924h111H2
MFCD03697911
ZINC000004395161
ZINC4395161
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