Vitas-M small molecule compound
5-cyano-4-(furan-2-yl)-2-methyl-6-({2-oxo-2-[(2,4,6-trimethylphenyl)amino]ethyl}sulfanyl)-N-[3-(trifluoromethyl)phenyl]-1,4-dihydropyridine-3-carboxamide
Catalog ID
STK886336
SMILES N#CC1=C(SCC(=O)Nc2c(C)cc(cc2C)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 C30H27F3N4O3S MW 580.63 g/mol Purity >90% as per NMR
InChI
InChI=1S/C30H27F3N4O3S/c1-16-11-17(2)27(18(3)12-16)37-24(38)15-41-29-22(14-34)26(23-9-6-10-40-23)25(19(4)35-29)28(39)36-21-8-5-7-20(13-21)30(31,32)33/h5-13,26,35H,15H2,1-4H3,(H,36,39)(H,37,38)InChIKey
FLQJFEPUAJGMPI-UHFFFAOYSA-NSynonyms
5cyano4(furan2yl)2methyl6((2oxo2((246trimethylphenyl)amino)ethyl)sulfanyl)N(3(trifluoromethyl)phenyl)14dihydropyridine3carboxamide
5cyano4(furan2yl)2methyl6(2oxo2(246trimethylanilino)ethyl)sulfanylN(3(trifluoromethyl)phenyl)14dihydropyridine3carboxamide
CC1=CC(=C(C(=C1)C)NC(=O)CSC2=C(C(C(=C(N2)C)C(=O)NC3=CC=CC(=C3)C(F)(F)F)C4=CC=CO4)C#N)C
InChI=1SC30H27F3N4O3Sc1161117(2)27(18(3)1216)3724(38)15412922(1434)26(2396104023)25(19(4)3529)28(39)362185720(1321)30(3132)33h5132635H15H214H3(H3639)(H3738)
MFCD10086807
ZINC000102808717
ZINC000102808719
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