Vitas-M small molecule compound
1-ethyl-6-fluoro-4-oxo-7-{4-[(thiophen-2-ylcarbonyl)carbamothioyl]piperazin-1-yl}-1,4-dihydroquinoline-3-carboxylic acid
Catalog ID
STK328903
SMILES CCn1cc(C(=O)O)c(=O)c2c1cc(N1CCN(CC1)C(=S)NC(=O)c1cccs1)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 C22H21FN4O4S2 MW 488.56 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H21FN4O4S2/c1-2-25-12-14(21(30)31)19(28)13-10-15(23)17(11-16(13)25)26-5-7-27(8-6-26)22(32)24-20(29)18-4-3-9-33-18/h3-4,9-12H,2,5-8H2,1H3,(H,30,31)(H,24,29,32)InChIKey
FPENYPFDPWLDNA-UHFFFAOYSA-NSynonyms
352024-87-41ethyl6fluoro4oxo7(4((thiophen2ylcarbonyl)carbamothioyl)piperazin1yl)14dihydroquinoline3carboxylicacid
1ethyl6fluoro4oxo7(4((thiophene2carbonyl)carbamothioyl)piperazin1yl)14dihydroquinoline3carboxylicacid
1ETHYL6FLUORO4OXO7(4(THIOPHENE2CARBONYLCARBAMOTHIOYL)PIPERAZIN1YL)QUINOLINE3CARBOXYLICACID
352024874
CCN1C=C(C(=O)C2=CC(=C(C=C21)N3CCN(CC3)C(=S)NC(=O)C4=CC=CS4)F)C(=O)O
InChI=1SC22H21FN4O4S2c12251214(21(30)31)19(28)131015(23)17(1116(13)25)265727(8626)22(32)2420(29)184393318h34912H258H21H3(H3031)(H242932)
MFCD01962719
ZINC000002343488
ZINC2343488
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