Vitas-M small molecule compound

{4-[(4-tert-butylphenyl)sulfonyl]piperazin-1-yl}(pyridin-4-yl)methanone

Catalog ID
STK487747
SMILES O=C(c1ccncc1)N1CCN(CC1)S(=O)(=O)c1ccc(cc1)C(C)(C)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/c1-20(2,3)17-4-6-18(7-5-17)27(25,26)23-14-12-22(13-15-23)19(24)16-8-10-21-11-9-16/h4-11H,12-15H2,1-3H3
InChIKey
YYJIAKKCYJGZAJ-UHFFFAOYSA-N
Synonyms
925580-68-3
(4((4tertbutylphenyl)sulfonyl)piperazin1yl)(pyridin4yl)methanone
(4(4tertbutylphenyl)sulfonylpiperazin1yl)pyridin4ylmethanone
4((4(TERTBUTYL)PHENYL)SULFONYL)PIPERAZINYL4PYRIDYLKETONE
925580683
CC(C)(C)C1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)C(=O)C3=CC=NC=C3
InChI=1SC20H25N3O3Sc120(23)174618(7517)27(2526)23141222(131523)19(24)168102111916h411H1215H213H3
MFCD09431445
ZINC000012381747
ZINC12381747

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Available files

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