Vitas-M small molecule compound
7-(azepan-1-yl)-1-benzyl-3-[(3-chlorophenyl)sulfonyl]-6-fluoroquinolin-4(1H)-one
Catalog ID
STL145528
SMILES Clc1cccc(c1)S(=O)(=O)c1cn(Cc2ccccc2)c2c(c1=O)cc(c(c2)N1CCCCCC1)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 C28H26ClFN2O3S MW 525.04 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H26ClFN2O3S/c29-21-11-8-12-22(15-21)36(34,35)27-19-32(18-20-9-4-3-5-10-20)25-17-26(24(30)16-23(25)28(27)33)31-13-6-1-2-7-14-31/h3-5,8-12,15-17,19H,1-2,6-7,13-14,18H2InChIKey
PZLBARXFNLIPBZ-UHFFFAOYSA-NSynonyms
892759-62-57(azepan1yl)1benzyl3((3chlorophenyl)sulfonyl)6fluoroquinolin4(1H)one
7(azepan1yl)1benzyl3(3chlorophenyl)sulfonyl6fluoroquinolin4one
892759625
C1CCCN(CC1)C2=C(C=C3C(=C2)N(C=C(C3=O)S(=O)(=O)C4=CC(=CC=C4)Cl)CC5=CC=CC=C5)F
InChI=1SC28H26ClFN2O3Sc29211181222(1521)36(3435)271932(182094351020)251726(24(30)1623(25)28(27)33)311361271431h35812151719H1267131418H2
MFCD14903054
ZINC000009436052
ZINC9436052
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