Vitas-M small molecule compound

{4-[(4-fluorophenyl)sulfonyl]piperazin-1-yl}(2-methylquinolin-4-yl)methanone

Catalog ID
STK654049
SMILES Fc1ccc(cc1)S(=O)(=O)N1CCN(CC1)C(=O)c1cc(C)nc2c1cccc2

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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 C21H20FN3O3S MW 413.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H20FN3O3S/c1-15-14-19(18-4-2-3-5-20(18)23-15)21(26)24-10-12-25(13-11-24)29(27,28)17-8-6-16(22)7-9-17/h2-9,14H,10-13H2,1H3
InChIKey
DHGBTHANCIVBDT-UHFFFAOYSA-N
Synonyms
849625-70-3
(4((4fluorophenyl)sulfonyl)piperazin1yl)(2methylquinolin4yl)methanone
(4(4FLUOROPHENYL)SULFONYLPIPERAZIN1YL)(2METHYLQUINOLIN4YL)METHANONE
849625703
CC1=NC2=CC=CC=C2C(=C1)C(=O)N3CCN(CC3)S(=O)(=O)C4=CC=C(C=C4)F
InChI=1SC21H20FN3O3Sc1151419(18423520(18)2315)21(26)24101225(131124)29(2728)178616(22)7917h2914H1013H21H3
MFCD07669645
ZINC000005613957
ZINC05613957
ZINC5613957

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.