Vitas-M small molecule compound

1-[(3-methoxyphenyl)sulfonyl]-4-(3-methylbutyl)piperazine

Catalog ID
STL429255
SMILES COc1cccc(c1)S(=O)(=O)N1CCN(CC1)CCC(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 C16H26N2O3S MW 326.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H26N2O3S/c1-14(2)7-8-17-9-11-18(12-10-17)22(19,20)16-6-4-5-15(13-16)21-3/h4-6,13-14H,7-12H2,1-3H3
InChIKey
MWSABDMRGTWIHF-UHFFFAOYSA-N
Synonyms

1((3methoxyphenyl)sulfonyl)4(3methylbutyl)piperazine
1(3methoxyphenyl)sulfonyl4(3methylbutyl)piperazine
CC(C)CCN1CCN(CC1)S(=O)(=O)C2=CC=CC(=C2)OC
InChI=1SC16H26N2O3Sc114(2)781791118(121017)22(1920)1664515(1316)213h461314H712H213H3
MFCD27634449
ZINC000096286903
ZINC96286903

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Available files

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