Vitas-M small molecule compound
ethyl 1-({[4-cyano-1-(trifluoromethyl)-6,7-dihydro-5H-cyclopenta[c]pyridin-3-yl]sulfanyl}methyl)-1H-pyrazole-3-carboxylate
Catalog ID
STL393905
SMILES CCOC(=O)c1ccn(n1)CSc1nc(c2c(c1C#N)CCC2)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 C17H15F3N4O2S MW 396.39 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H15F3N4O2S/c1-2-26-16(25)13-6-7-24(23-13)9-27-15-12(8-21)10-4-3-5-11(10)14(22-15)17(18,19)20/h6-7H,2-5,9H2,1H3InChIKey
ZPFDEOQLQBZYBU-UHFFFAOYSA-NSynonyms
1005667-76-41005667764
CCOC(=O)C1=NN(C=C1)CSC2=NC(=C3CCCC3=C2C#N)C(F)(F)F
ETHYL1(((4CYANO1(TRIFLUOROMETHYL)67DIHYDRO5HCYCLOPENTA(C)PYRIDIN3YL)SULFANYL)METHYL)1HPYRAZOLE3CARBOXYLATE
ETHYL1((4CYANO1(TRIFLUOROMETHYL)67DIHYDRO5HCYCLOPENTA(C)PYRIDIN3YL)SULFANYLMETHYL)PYRAZOLE3CARBOXYLATE
InChI=1SC17H15F3N4O2Sc122616(25)136724(2313)9271512(821)1043511(10)14(2215)17(1819)20h67H259H21H3
MFCD04049624
ZINC000002782768
ZINC02782768
ZINC2782768
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