Vitas-M small molecule compound
7-{4-[(1,3-benzodioxol-5-ylcarbonyl)carbamothioyl]piperazin-1-yl}-1-ethyl-6-fluoro-4-oxo-1,4-dihydro-1,8-naphthyridine-3-carboxylic acid
Catalog ID
STK542126
SMILES CCn1cc(C(=O)O)c(=O)c2c1nc(N1CCN(CC1)C(=S)NC(=O)c1ccc3c(c1)OCO3)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 C24H22FN5O6S MW 527.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H22FN5O6S/c1-2-28-11-15(23(33)34)19(31)14-10-16(25)21(26-20(14)28)29-5-7-30(8-6-29)24(37)27-22(32)13-3-4-17-18(9-13)36-12-35-17/h3-4,9-11H,2,5-8,12H2,1H3,(H,33,34)(H,27,32,37)InChIKey
BPOOGIQVWPXRPW-UHFFFAOYSA-NSynonyms
498538-26-4498538264
7(4((13benzodioxol5ylcarbonyl)carbamothioyl)piperazin1yl)1ethyl6fluoro4oxo14dihydro18naphthyridine3carboxylicacid
7(4((benzo(d)(13)dioxole5carbonyl)carbamothioyl)piperazin1yl)1ethyl6fluoro4oxo14dihydro18naphthyridine3carboxylicacid
7(4(13BENZODIOXOLE5CARBONYLCARBAMOTHIOYL)PIPERAZIN1YL)1ETHYL6FLUORO4OXO18NAPHTHYRIDINE3CARBOXYLICACID
CCN1C=C(C(=O)C2=CC(=C(N=C21)N3CCN(CC3)C(=S)NC(=O)C4=CC5=C(C=C4)OCO5)F)C(=O)O
InChI=1SC24H22FN5O6Sc12281115(23(33)34)19(31)141016(25)21(2620(14)28)295730(8629)24(37)2722(32)13341718(913)36123517h34911H25812H21H3(H3334)(H273237)
MFCD03301890
ZINC000002349210
ZINC2349210
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