Vitas-M small molecule compound
7-(4-{[(4-chlorophenyl)carbonyl]carbamothioyl}piperazin-1-yl)-1-ethyl-6-fluoro-4-oxo-1,4-dihydroquinoline-3-carboxylic acid
Catalog ID
STK328905
SMILES CCn1cc(C(=O)O)c(=O)c2c1cc(N1CCN(CC1)C(=S)NC(=O)c1ccc(cc1)Cl)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 C24H22ClFN4O4S MW 516.98 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H22ClFN4O4S/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
JZWDIAFQXZPNRG-UHFFFAOYSA-NSynonyms
151292-91-0151292910
7(4(((4chlorophenyl)carbonyl)carbamothioyl)piperazin1yl)1ethyl6fluoro4oxo14dihydroquinoline3carboxylicacid
7(4((4chlorobenzoyl)carbamothioyl)piperazin1yl)1ethyl6fluoro4oxo14dihydroquinoline3carboxylicacid
7(4((4CHLOROBENZOYL)CARBAMOTHIOYL)PIPERAZIN1YL)1ETHYL6FLUORO4OXOQUINOLINE3CARBOXYLICACID
CCN1C=C(C(=O)C2=CC(=C(C=C21)N3CCN(CC3)C(=S)NC(=O)C4=CC=C(C=C4)Cl)F)C(=O)O
InChI=1SC24H22ClFN4O4Sc12281317(23(33)34)21(31)161118(26)20(1219(16)28)297930(10829)24(35)2722(32)143515(25)6414h361113H2710H21H3(H3334)(H273235)
MFCD01994237
ZINC000002316708
ZINC2316708
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