Vitas-M small molecule compound
2-{[(3,5-dimethyl-4-nitro-1H-pyrazol-1-yl)methyl]sulfanyl}-4-(4-methoxyphenyl)-6-(trifluoromethyl)pyridine-3-carbonitrile
Catalog ID
STK305165
SMILES N#Cc1c(SCn2nc(c(c2C)[N+](=O)[O-])C)nc(cc1c1ccc(cc1)OC)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 C20H16F3N5O3S MW 463.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H16F3N5O3S/c1-11-18(28(29)30)12(2)27(26-11)10-32-19-16(9-24)15(8-17(25-19)20(21,22)23)13-4-6-14(31-3)7-5-13/h4-8H,10H2,1-3H3InChIKey
YWJQNXGMNYRFON-UHFFFAOYSA-NSynonyms
1005611-24-41005611244
2(((35dimethyl4nitro1Hpyrazol1yl)methyl)sulfanyl)4(4methoxyphenyl)6(trifluoromethyl)pyridine3carbonitrile
2((35DIMETHYL4NITROPYRAZOL1YL)METHYLSULFANYL)4(4METHOXYPHENYL)6(TRIFLUOROMETHYL)PYRIDINE3CARBONITRILE
CC1=C(C(=NN1CSC2=C(C(=CC(=N2)C(F)(F)F)C3=CC=C(C=C3)OC)C#N)C)(N+)(=O)(O)
InChI=1SC20H16F3N5O3Sc11118(28(29)30)12(2)27(2611)10321916(924)15(817(2519)20(2122)23)134614(313)7513h48H10H213H3
MFCD04050074
N#Cc1c(SCn2nc(c(c2C)(N+)(=O)(O))C)nc(cc1c1ccc(cc1)OC)C(F)(F)F
ZINC000002785060
ZINC02785060
ZINC2785060
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