Vitas-M small molecule compound
propan-2-yl 6-amino-4-(2-chlorophenyl)-5-cyano-2-{[(3-cyano-4,6-dimethylpyridin-2-yl)sulfanyl]methyl}-4H-pyran-3-carboxylate
Catalog ID
STK526343
SMILES N#CC1=C(N)OC(=C(C1c1ccccc1Cl)C(=O)OC(C)C)CSc1nc(C)cc(c1C#N)C
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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 C25H23ClN4O3S MW 495.00 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H23ClN4O3S/c1-13(2)32-25(31)22-20(12-34-24-17(10-27)14(3)9-15(4)30-24)33-23(29)18(11-28)21(22)16-7-5-6-8-19(16)26/h5-9,13,21H,12,29H2,1-4H3InChIKey
CTVMNTFXLZKAPZ-UHFFFAOYSA-NSynonyms
370075-20-01METHYLETHYL6AMINO4(2CHLOROPHENYL)5CYANO2(((3CYANO46DIMETHYLPYRIDIN2YL)SULFANYL)METHYL)4HPYRAN3CARBOXYLATE
370075200
CC1=CC(=NC(=C1C#N)SCC2=C(C(C(=C(O2)N)C#N)C3=CC=CC=C3Cl)C(=O)OC(C)C)C
InChI=1SC25H23ClN4O3Sc113(2)3225(31)2220(12342417(1027)14(3)915(4)3024)3323(29)18(1128)21(22)16756819(16)26h591321H1229H214H3
isopropyl6amino4(2chlorophenyl)5cyano2(((3cyano46dimethylpyridin2yl)thio)methyl)4Hpyran3carboxylate
MFCD01557215
propan2yl6amino4(2chlorophenyl)5cyano2(((3cyano46dimethylpyridin2yl)sulfanyl)methyl)4Hpyran3carboxylate
PROPAN2YL6AMINO4(2CHLOROPHENYL)5CYANO2((3CYANO46DIMETHYLPYRIDIN2YL)SULFANYLMETHYL)4HPYRAN3CARBOXYLATE
ZINC000008934386
ZINC000008934631
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