Vitas-M small molecule compound

ethyl 6-amino-2-({[4-(4-chlorophenyl)-3-cyano-6-(thiophen-2-yl)pyridin-2-yl]sulfanyl}methyl)-5-cyano-4-(4-fluorophenyl)-4H-pyran-3-carboxylate

Catalog ID
STK524330
SMILES CCOC(=O)C1=C(CSc2nc(cc(c2C#N)c2ccc(cc2)Cl)c2cccs2)OC(=C(C1c1ccc(cc1)F)C#N)N

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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 C32H22ClFN4O3S2 MW 629.13 g/mol Purity >90% as per NMR
InChI
InChI=1S/C32H22ClFN4O3S2/c1-2-40-32(39)29-26(41-30(37)24(16-36)28(29)19-7-11-21(34)12-8-19)17-43-31-23(15-35)22(18-5-9-20(33)10-6-18)14-25(38-31)27-4-3-13-42-27/h3-14,28H,2,17,37H2,1H3
InChIKey
KXHJVLYLSRIUPS-UHFFFAOYSA-N
Synonyms

CCOC(=O)C1=C(OC(=C(C1C2=CC=C(C=C2)F)C#N)N)CSC3=C(C(=CC(=N3)C4=CC=CS4)C5=CC=C(C=C5)Cl)C#N
ETHYL6AMINO2(((4(4CHLOROPHENYL)3CYANO6(2THIENYL)2PYRIDINYL)SULFANYL)METHYL)5CYANO4(4FLUOROPHENYL)4HPYRAN3CARBOXYLATE
ethyl6amino2(((4(4chlorophenyl)3cyano6(thiophen2yl)pyridin2yl)sulfanyl)methyl)5cyano4(4fluorophenyl)4Hpyran3carboxylate
ethyl6amino2(((4(4chlorophenyl)3cyano6(thiophen2yl)pyridin2yl)thio)methyl)5cyano4(4fluorophenyl)4Hpyran3carboxylate
ETHYL6AMINO2((4(4CHLOROPHENYL)3CYANO6THIOPHEN2YLPYRIDIN2YL)SULFANYLMETHYL)5CYANO4(4FLUOROPHENYL)4HPYRAN3CARBOXYLATE
InChI=1SC32H22ClFN4O3S2c124032(39)2926(4130(37)24(1636)28(29)1971121(34)12819)17433123(1535)22(185920(33)10618)1425(3831)2743134227h31428H21737H21H3
MFCD01114201
ZINC000008448642
ZINC000008448643

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Available files

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