Vitas-M small molecule compound
methyl 5-({[4-cyano-1-(trifluoromethyl)-6,7-dihydro-5H-cyclopenta[c]pyridin-3-yl]sulfanyl}methyl)furan-2-carboxylate
Catalog ID
STL173004
SMILES COC(=O)c1ccc(o1)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 C17H13F3N2O3S MW 382.36 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H13F3N2O3S/c1-24-16(23)13-6-5-9(25-13)8-26-15-12(7-21)10-3-2-4-11(10)14(22-15)17(18,19)20/h5-6H,2-4,8H2,1H3InChIKey
ATBWDYOAJMTKRZ-UHFFFAOYSA-NSynonyms
514839-51-1514839511
COC(=O)C1=CC=C(O1)CSC2=NC(=C3CCCC3=C2C#N)C(F)(F)F
InChI=1SC17H13F3N2O3Sc12416(23)13659(2513)8261512(721)1032411(10)14(2215)17(1819)20h56H248H21H3
methyl5(((4cyano1(trifluoromethyl)67dihydro5Hcyclopenta(c)pyridin3yl)sulfanyl)methyl)furan2carboxylate
METHYL5(((4CYANO1(TRIFLUOROMETHYL)67DIHYDRO5HCYCLOPENTA(C)PYRIDIN3YL)THIO)METHYL)2FUROATE
METHYL5((4CYANO1(TRIFLUOROMETHYL)67DIHYDRO5HCYCLOPENTA(C)PYRIDIN3YL)SULFANYLMETHYL)FURAN2CARBOXYLATE
MFCD03757672
ZINC000001000862
ZINC1000862
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