Vitas-M small molecule compound
6-{[2-(tert-butylamino)-2-oxoethyl]sulfanyl}-5-cyano-4-(furan-2-yl)-2-methyl-N-[3-(trifluoromethyl)phenyl]-1,4-dihydropyridine-3-carboxamide
Catalog ID
STL001321
SMILES N#CC1=C(SCC(=O)NC(C)(C)C)NC(=C(C1c1ccco1)C(=O)Nc1cccc(c1)C(F)(F)F)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 C25H25F3N4O3S MW 518.56 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H25F3N4O3S/c1-14-20(22(34)31-16-8-5-7-15(11-16)25(26,27)28)21(18-9-6-10-35-18)17(12-29)23(30-14)36-13-19(33)32-24(2,3)4/h5-11,21,30H,13H2,1-4H3,(H,31,34)(H,32,33)InChIKey
HHDAHMVAJHKGBI-UHFFFAOYSA-NSynonyms
799818-47-66((2(tertbutylamino)2oxoethyl)sulfanyl)5cyano4(furan2yl)2methylN(3(trifluoromethyl)phenyl)14dihydropyridine3carboxamide
6((2(tertbutylamino)2oxoethyl)thio)5cyano4(furan2yl)2methylN(3(trifluoromethyl)phenyl)14dihydropyridine3carboxamide
6(2(TERTBUTYLAMINO)2OXOETHYL)SULFANYL5CYANO4(FURAN2YL)2METHYLN(3(TRIFLUOROMETHYL)PHENYL)14DIHYDROPYRIDINE3CARBOXAMIDE
799818476
CC1=C(C(C(=C(N1)SCC(=O)NC(C)(C)C)C#N)C2=CC=CO2)C(=O)NC3=CC=CC(=C3)C(F)(F)F
InChI=1SC25H25F3N4O3Sc11420(22(34)311685715(1116)25(2627)28)21(1896103518)17(1229)23(3014)361319(33)3224(23)4h5112130H13H214H3(H3134)(H3233)
MFCD03681576
ZINC000009428576
ZINC000009433853
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