Vitas-M small molecule compound
1-butyl-3-[(3-chlorophenyl)sulfonyl]-7-(4-ethylpiperazin-1-yl)-6-fluoroquinolin-4(1H)-one
Catalog ID
STL145506
SMILES CCCCn1cc(c(=O)c2c1cc(N1CCN(CC1)CC)c(c2)F)S(=O)(=O)c1cccc(c1)Cl
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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 C25H29ClFN3O3S MW 506.04 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H29ClFN3O3S/c1-3-5-9-30-17-24(34(32,33)19-8-6-7-18(26)14-19)25(31)20-15-21(27)23(16-22(20)30)29-12-10-28(4-2)11-13-29/h6-8,14-17H,3-5,9-13H2,1-2H3InChIKey
VCQIJLIRCNAWHG-UHFFFAOYSA-NSynonyms
892758-92-81butyl3((3chlorophenyl)sulfonyl)7(4ethylpiperazin1yl)6fluoroquinolin4(1H)one
1butyl3(3chlorophenyl)sulfonyl7(4ethylpiperazin1yl)6fluoroquinolin4one
892758928
CCCCN1C=C(C(=O)C2=CC(=C(C=C21)N3CCN(CC3)CC)F)S(=O)(=O)C4=CC(=CC=C4)Cl
InChI=1SC25H29ClFN3O3Sc1359301724(34(3233)1986718(26)1419)25(31)201521(27)23(1622(20)30)29121028(42)111329h681417H35913H212H3
MFCD14903043
ZINC000009436040
ZINC9436040
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