Vitas-M small molecule compound
1-ethyl-6-fluoro-7-(4-{[(4-fluorophenyl)carbonyl]carbamothioyl}piperazin-1-yl)-4-oxo-1,4-dihydroquinoline-3-carboxylic acid
Catalog ID
STK328904
SMILES CCn1cc(C(=O)O)c(=O)c2c1cc(N1CCN(CC1)C(=S)NC(=O)c1ccc(cc1)F)c(c2)F
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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 C24H22F2N4O4S MW 500.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H22F2N4O4S/c1-2-28-13-17(23(33)34)21(31)16-11-18(26)20(12-19(16)28)29-7-9-30(10-8-29)24(35)27-22(32)14-3-5-15(25)6-4-14/h3-6,11-13H,2,7-10H2,1H3,(H,33,34)(H,27,32,35)InChIKey
YMBBRFTWUIAWGK-UHFFFAOYSA-NSynonyms
496773-94-51ETHYL6FLUORANYL7(4((4FLUOROPHENYL)CARBONYLCARBAMOTHIOYL)PIPERAZIN1YL)4OXIDANYLIDENEQUINOLINE3CARBOXYLICACID
1ETHYL6FLUORO7(4((((4FLUOROPHENYL)OXOMETHYL)AMINO)SULFANYLIDENEMETHYL)1PIPERAZINYL)4OXO3QUINOLINECARBOXYLICACID
1ethyl6fluoro7(4(((4fluorophenyl)carbonyl)carbamothioyl)piperazin1yl)4oxo14dihydroquinoline3carboxylicacid
1ETHYL6FLUORO7(4((4FLUOROBENZOYL)CARBAMOTHIOYL)PIPERAZIN1YL)4OXO14DIHYDROQUINOLINE3CARBOXYLICACID
1ETHYL6FLUORO7(4((4FLUOROBENZOYL)CARBAMOTHIOYL)PIPERAZIN1YL)4OXOQUINOLINE3CARBOXYLICACID
1ETHYL6FLUORO7(4((4FLUOROBENZOYL)THIOCARBAMOYL)PIPERAZINO)4KETOQUINOLINE3CARBOXYLICACID
1ETHYL6FLUORO7(4(4FLUOROBENZOYLAMINOCARBOTHIOYL)PIPERAZIN1YL)4OXO14DIHYDROQUINOLINE3CARBOXYLICACID
496773945
CCN1C=C(C(=O)C2=CC(=C(C=C21)N3CCN(CC3)C(=S)NC(=O)C4=CC=C(C=C4)F)F)C(=O)O
InChI=1SC24H22F2N4O4Sc12281317(23(33)34)21(31)161118(26)20(1219(16)28)297930(10829)24(35)2722(32)143515(25)6414h361113H2710H21H3(H3334)(H273235)
MFCD01962720
ZINC000002300761
ZINC2300761
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