Vitas-M small molecule compound

butyl 4-({[1-(thiophen-2-ylsulfonyl)piperidin-4-yl]carbonyl}amino)benzoate

Catalog ID
STL116380
SMILES CCCCOC(=O)c1ccc(cc1)NC(=O)C1CCN(CC1)S(=O)(=O)c1cccs1

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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 C21H26N2O5S2 MW 450.58 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H26N2O5S2/c1-2-3-14-28-21(25)17-6-8-18(9-7-17)22-20(24)16-10-12-23(13-11-16)30(26,27)19-5-4-15-29-19/h4-9,15-16H,2-3,10-14H2,1H3,(H,22,24)
InChIKey
JCQRZPJCHOHHRP-UHFFFAOYSA-N
Synonyms

butyl4(((1(thiophen2ylsulfonyl)piperidin4yl)carbonyl)amino)benzoate
butyl4((1thiophen2ylsulfonylpiperidine4carbonyl)amino)benzoate
CCCCOC(=O)C1=CC=C(C=C1)NC(=O)C2CCN(CC2)S(=O)(=O)C3=CC=CS3
InChI=1SC21H26N2O5S2c123142821(25)176818(9717)2220(24)16101223(131116)30(2627)1954152919h491516H231014H21H3(H2224)
MFCD14822459
ZINC000014862332
ZINC14862332

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Available files

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