Vitas-M small molecule compound

3-methyl-1-(4-{[4-(propan-2-yl)phenyl]sulfonyl}piperazin-1-yl)butan-1-one

Catalog ID
STK487531
SMILES CC(CC(=O)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 C18H28N2O3S MW 352.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H28N2O3S/c1-14(2)13-18(21)19-9-11-20(12-10-19)24(22,23)17-7-5-16(6-8-17)15(3)4/h5-8,14-15H,9-13H2,1-4H3
InChIKey
QMMLUCZBQVGKEF-UHFFFAOYSA-N
Synonyms

3METHYL1(4((4(METHYLETHYL)PHENYL)SULFONYL)PIPERAZINYL)BUTAN1ONE
3methyl1(4((4(propan2yl)phenyl)sulfonyl)piperazin1yl)butan1one
3METHYL1(4(4PROPAN2YLPHENYL)SULFONYLPIPERAZIN1YL)BUTAN1ONE
CC(C)CC(=O)N1CCN(CC1)S(=O)(=O)C2=CC=C(C=C2)C(C)C
InChI=1SC18H28N2O3Sc114(2)1318(21)1991120(121019)24(2223)177516(6817)15(3)4h581415H913H214H3
MFCD09431389
ZINC000002939791
ZINC02939791
ZINC2939791

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Available files

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