Vitas-M small molecule compound
3-{[(4-bromo-1H-pyrazol-1-yl)methyl]sulfanyl}-1-(trifluoromethyl)-5,6,7,8-tetrahydroisoquinoline-4-carbonitrile
Catalog ID
STL402418
SMILES N#Cc1c(SCn2ncc(c2)Br)nc(c2c1CCCC2)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 C15H12BrF3N4S MW 417.25 g/mol Purity >90% as per NMR
InChI
InChI=1S/C15H12BrF3N4S/c16-9-6-21-23(7-9)8-24-14-12(5-20)10-3-1-2-4-11(10)13(22-14)15(17,18)19/h6-7H,1-4,8H2InChIKey
NMNZNQIVCZFHSF-UHFFFAOYSA-NSynonyms
1005670-05-21005670052
3(((4bromo1Hpyrazol1yl)methyl)sulfanyl)1(trifluoromethyl)5678tetrahydroisoquinoline4carbonitrile
3((4bromopyrazol1yl)methylsulfanyl)1(trifluoromethyl)5678tetrahydroisoquinoline4carbonitrile
C1CCC2=C(N=C(C(=C2C1)C#N)SCN3C=C(C=N3)Br)C(F)(F)F
InChI=1SC15H12BrF3N4Sc16962123(79)8241412(520)10312411(10)13(2214)15(1718)19h67H148H2
MFCD04049629
ZINC000017090959
ZINC17090959
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