Vitas-M small molecule compound

(4-{[4-(2-methylpropyl)phenyl]sulfonyl}piperazin-1-yl)(pyridin-3-yl)methanone

Catalog ID
STK487542
SMILES CC(Cc1ccc(cc1)S(=O)(=O)N1CCN(CC1)C(=O)c1cccnc1)C

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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 C20H25N3O3S MW 387.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H25N3O3S/c1-16(2)14-17-5-7-19(8-6-17)27(25,26)23-12-10-22(11-13-23)20(24)18-4-3-9-21-15-18/h3-9,15-16H,10-14H2,1-2H3
InChIKey
ALEGVUHPCXFGNO-UHFFFAOYSA-N
Synonyms

(4((4(2methylpropyl)phenyl)sulfonyl)piperazin1yl)(pyridin3yl)methanone
(4(4(2methylpropyl)phenyl)sulfonylpiperazin1yl)pyridin3ylmethanone
4((4(2METHYLPROPYL)PHENYL)SULFONYL)PIPERAZINYL3PYRIDYLKETONE
CC(C)CC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)C(=O)C3=CN=CC=C3
InChI=1SC20H25N3O3Sc116(2)14175719(8617)27(2526)23121022(111323)20(24)18439211518h391516H1014H212H3
MFCD09431397
ZINC000012382390
ZINC12382390

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Available files

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