Vitas-M small molecule compound
6-[(2-amino-2-oxoethyl)sulfanyl]-N-[2-chloro-5-(trifluoromethyl)phenyl]-5-cyano-4-(furan-2-yl)-2-methyl-1,4-dihydropyridine-3-carboxamide
Catalog ID
STK826442
SMILES N#CC1=C(SCC(=O)N)NC(=C(C1c1ccco1)C(=O)Nc1cc(ccc1Cl)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 C21H16ClF3N4O3S MW 496.90 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H16ClF3N4O3S/c1-10-17(19(31)29-14-7-11(21(23,24)25)4-5-13(14)22)18(15-3-2-6-32-15)12(8-26)20(28-10)33-9-16(27)30/h2-7,18,28H,9H2,1H3,(H2,27,30)(H,29,31)InChIKey
QMRJLMKJCSPBBF-UHFFFAOYSA-NSynonyms
701242-14-06((2amino2oxoethyl)sulfanyl)N(2chloro5(trifluoromethyl)phenyl)5cyano4(furan2yl)2methyl14dihydropyridine3carboxamide
6((2amino2oxoethyl)thio)N(2chloro5(trifluoromethyl)phenyl)5cyano4(furan2yl)2methyl14dihydropyridine3carboxamide
6(2AMINO2OXOETHYL)SULFANYLN(2CHLORO5(TRIFLUOROMETHYL)PHENYL)5CYANO4(FURAN2YL)2METHYL14DIHYDROPYRIDINE3CARBOXAMIDE
701242140
CC1=C(C(C(=C(N1)SCC(=O)N)C#N)C2=CC=CO2)C(=O)NC3=C(C=CC(=C3)C(F)(F)F)Cl
InChI=1SC21H16ClF3N4O3Sc11017(19(31)2914711(21(2324)25)4513(14)22)18(153263215)12(826)20(2810)33916(27)30h271828H9H21H3(H22730)(H2931)
MFCD04014875
ZINC000009457945
ZINC000009471099
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