Vitas-M small molecule compound
6-{[2-(benzylamino)-2-oxoethyl]sulfanyl}-5-cyano-N-(2-fluorophenyl)-4-(furan-2-yl)-2-methyl-1,4-dihydropyridine-3-carboxamide
Catalog ID
STK997389
SMILES N#CC1=C(SCC(=O)NCc2ccccc2)NC(=C(C1c1ccco1)C(=O)Nc1ccccc1F)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 C27H23FN4O3S MW 502.57 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H23FN4O3S/c1-17-24(26(34)32-21-11-6-5-10-20(21)28)25(22-12-7-13-35-22)19(14-29)27(31-17)36-16-23(33)30-15-18-8-3-2-4-9-18/h2-13,25,31H,15-16H2,1H3,(H,30,33)(H,32,34)InChIKey
RDZKCZLLCTZRHC-UHFFFAOYSA-NSynonyms
693235-71-16((2(benzylamino)2oxoethyl)sulfanyl)5cyanoN(2fluorophenyl)4(furan2yl)2methyl14dihydropyridine3carboxamide
6((2(benzylamino)2oxoethyl)thio)5cyanoN(2fluorophenyl)4(furan2yl)2methyl14dihydropyridine3carboxamide
6(2(BENZYLAMINO)2OXOETHYL)SULFANYL5CYANON(2FLUOROPHENYL)4(FURAN2YL)2METHYL14DIHYDROPYRIDINE3CARBOXAMIDE
693235711
CC1=C(C(C(=C(N1)SCC(=O)NCC2=CC=CC=C2)C#N)C3=CC=CO3)C(=O)NC4=CC=CC=C4F
InChI=1SC27H23FN4O3Sc11724(26(34)322111651020(21)28)25(22127133522)19(1429)27(3117)361623(33)3015188324918h2132531H1516H21H3(H3033)(H3234)
MFCD03670175
ZINC000009075336
ZINC000009075337
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