Vitas-M small molecule compound
ethyl 2-amino-6-{[(4-chlorophenyl)sulfanyl]methyl}-5-cyano-4-(3,4,5-trimethoxyphenyl)-4H-pyran-3-carboxylate
Catalog ID
STK788629
SMILES CCOC(=O)C1=C(N)OC(=C(C1c1cc(OC)c(c(c1)OC)OC)C#N)CSc1ccc(cc1)Cl
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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 C25H25ClN2O6S MW 517.00 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H25ClN2O6S/c1-5-33-25(29)22-21(14-10-18(30-2)23(32-4)19(11-14)31-3)17(12-27)20(34-24(22)28)13-35-16-8-6-15(26)7-9-16/h6-11,21H,5,13,28H2,1-4H3InChIKey
WBFBTAPELKBRJO-UHFFFAOYSA-NSynonyms
370572-23-9370572239
CCOC(=O)C1=C(OC(=C(C1C2=CC(=C(C(=C2)OC)OC)OC)C#N)CSC3=CC=C(C=C3)Cl)N
ethyl2amino6(((4chlorophenyl)sulfanyl)methyl)5cyano4(345trimethoxyphenyl)4Hpyran3carboxylate
ethyl2amino6(((4chlorophenyl)thio)methyl)5cyano4(345trimethoxyphenyl)4Hpyran3carboxylate
ETHYL2AMINO6((4CHLOROPHENYL)SULFANYLMETHYL)5CYANO4(345TRIMETHOXYPHENYL)4HPYRAN3CARBOXYLATE
InChI=1SC25H25ClN2O6Sc153325(29)2221(141018(302)23(324)19(1114)313)17(1227)20(3424(22)28)1335168615(26)7916h61121H51328H214H3
MFCD03010954
ZINC000009428081
ZINC000009428084
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