Vitas-M small molecule compound

{4-[(4-tert-butylphenyl)sulfonyl]piperazin-1-yl}(pyridin-3-yl)methanone

Catalog ID
STK487746
SMILES O=C(c1cccnc1)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)17-6-8-18(9-7-17)27(25,26)23-13-11-22(12-14-23)19(24)16-5-4-10-21-15-16/h4-10,15H,11-14H2,1-3H3
InChIKey
ZJOJBOJCEHFHFN-UHFFFAOYSA-N
Synonyms

(4((4tertbutylphenyl)sulfonyl)piperazin1yl)(pyridin3yl)methanone
(4(4TERTBUTYLPHENYL)SULFONYLPIPERAZIN1YL)PYRIDIN3YLMETHANONE
4((4(TERTBUTYL)PHENYL)SULFONYL)PIPERAZINYL3PYRIDYLKETONE
CC(C)(C)C1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)C(=O)C3=CN=CC=C3
InChI=1SC20H25N3O3Sc120(23)176818(9717)27(2526)23131122(121423)19(24)165410211516h41015H1114H213H3
MFCD09431444
ZINC000008088683
ZINC08088683
ZINC8088683

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Available files

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