Vitas-M small molecule compound
1-cyclopropyl-7-(4-{[(2,4-dichlorophenyl)carbonyl]carbamothioyl}piperazin-1-yl)-6-fluoro-4-oxo-1,4-dihydroquinoline-3-carboxylic acid
Catalog ID
STK684309
SMILES Clc1ccc(c(c1)Cl)C(=O)NC(=S)N1CCN(CC1)c1cc2n(cc(c(=O)c2cc1F)C(=O)O)C1CC1
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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 C25H21Cl2FN4O4S MW 563.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H21Cl2FN4O4S/c26-13-1-4-15(18(27)9-13)23(34)29-25(37)31-7-5-30(6-8-31)21-11-20-16(10-19(21)28)22(33)17(24(35)36)12-32(20)14-2-3-14/h1,4,9-12,14H,2-3,5-8H2,(H,35,36)(H,29,34,37)InChIKey
YWOGAZVRHJBILZ-UHFFFAOYSA-NSynonyms
1cyclopropyl7(4(((24dichlorophenyl)carbonyl)carbamothioyl)piperazin1yl)6fluoro4oxo14dihydroquinoline3carboxylicacid
1CYCLOPROPYL7(4((24DICHLOROBENZOYL)CARBAMOTHIOYL)PIPERAZIN1YL)6FLUORO4OXOQUINOLINE3CARBOXYLICACID
C1CC1N2C=C(C(=O)C3=CC(=C(C=C32)N4CCN(CC4)C(=S)NC(=O)C5=C(C=C(C=C5)Cl)Cl)F)C(=O)O
InChI=1SC25H21Cl2FN4O4Sc26131415(18(27)913)23(34)2925(37)317530(6831)21112016(1019(21)28)22(33)17(24(35)36)1232(20)142314h1491214H2358H2(H3536)(H293437)
MFCD05260316
ZINC000100166381
ZINC100166381
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