Vitas-M small molecule compound

7-(4-{[(4-chlorophenyl)carbonyl]carbamothioyl}piperazin-1-yl)-1-cyclopropyl-6-fluoro-4-oxo-1,4-dihydroquinoline-3-carboxylic acid

Catalog ID
STK769923
SMILES Clc1ccc(cc1)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 C25H22ClFN4O4S MW 528.99 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H22ClFN4O4S/c26-15-3-1-14(2-4-15)23(33)28-25(36)30-9-7-29(8-10-30)21-12-20-17(11-19(21)27)22(32)18(24(34)35)13-31(20)16-5-6-16/h1-4,11-13,16H,5-10H2,(H,34,35)(H,28,33,36)
InChIKey
WLNHZGUFSYARDD-UHFFFAOYSA-N
Synonyms
663938-44-1
663938441
7(4(((4chlorophenyl)carbonyl)carbamothioyl)piperazin1yl)1cyclopropyl6fluoro4oxo14dihydroquinoline3carboxylicacid
7(4((4chlorobenzoyl)carbamothioyl)piperazin1yl)1cyclopropyl6fluoro4oxo14dihydroquinoline3carboxylicacid
7(4((4CHLOROBENZOYL)CARBAMOTHIOYL)PIPERAZIN1YL)1CYCLOPROPYL6FLUORO4OXOQUINOLINE3CARBOXYLICACID
C1CC1N2C=C(C(=O)C3=CC(=C(C=C32)N4CCN(CC4)C(=S)NC(=O)C5=CC=C(C=C5)Cl)F)C(=O)O
InChI=1SC25H22ClFN4O4Sc26153114(2415)23(33)2825(36)309729(81030)21122017(1119(21)27)22(32)18(24(34)35)1331(20)165616h14111316H510H2(H3435)(H283336)
MFCD03675239
ZINC000029748026
ZINC29748026

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Available files

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