Vitas-M small molecule compound

2-methyl-N-[4-(pyrrolidin-1-ylsulfonyl)phenyl]piperidine-1-carbothioamide

Catalog ID
STK463174
SMILES CC1CCCCN1C(=S)Nc1ccc(cc1)S(=O)(=O)N1CCCC1

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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 C17H25N3O2S2 MW 367.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H25N3O2S2/c1-14-6-2-3-13-20(14)17(23)18-15-7-9-16(10-8-15)24(21,22)19-11-4-5-12-19/h7-10,14H,2-6,11-13H2,1H3,(H,18,23)
InChIKey
IIOGJJRROBPQBP-UHFFFAOYSA-N
Synonyms

((4(((2METHYLPIPERIDYL)THIOXOMETHYL)AMINO)PHENYL)SULFONYL)PYRROLIDINE
2methylN(4(pyrrolidin1ylsulfonyl)phenyl)piperidine1carbothioamide
2methylN(4pyrrolidin1ylsulfonylphenyl)piperidine1carbothioamide
CC1CCCCN1C(=S)NC2=CC=C(C=C2)S(=O)(=O)N3CCCC3
InChI=1SC17H25N3O2S2c1146231320(14)17(23)18157916(10815)24(2122)1911451219h71014H261113H21H3(H1823)
MFCD06757631
ZINC000017075501
ZINC000017075502

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Available files

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