Vitas-M small molecule compound

N-[(2S)-1-(cyclopentylamino)-4-(methylsulfanyl)-1-oxobutan-2-yl]-1-[(4-fluorophenyl)sulfonyl]piperidine-4-carboxamide

Catalog ID
STK618365
SMILES CSCC[C@@H](C(=O)NC1CCCC1)NC(=O)C1CCN(CC1)S(=O)(=O)c1ccc(cc1)F

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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 C22H32FN3O4S2 MW 485.64 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H32FN3O4S2/c1-31-15-12-20(22(28)24-18-4-2-3-5-18)25-21(27)16-10-13-26(14-11-16)32(29,30)19-8-6-17(23)7-9-19/h6-9,16,18,20H,2-5,10-15H2,1H3,(H,24,28)(H,25,27)/t20-/m0/s1
InChIKey
LYVCCNAFUCIOGV-FQEVSTJZSA-N
Synonyms
1014408-88-8
(S)N(1(cyclopentylamino)4(methylthio)1oxobutan2yl)1((4fluorophenyl)sulfonyl)piperidine4carboxamide
1014408888
CSCC(C@@H)(C(=O)NC1CCCC1)NC(=O)C1CCN(CC1)S(=O)(=O)c1ccc(cc1)F
CSCCC(C(=O)NC1CCCC1)NC(=O)C2CCN(CC2)S(=O)(=O)C3=CC=C(C=C3)F
InChI=1SC22H32FN3O4S2c131151220(22(28)2418423518)2521(27)16101326(141116)32(2930)198617(23)7919h69161820H251015H21H3(H2428)(H2527)t20m0s1
MFCD09851935
N((2S)1(cyclopentylamino)4(methylsulfanyl)1oxobutan2yl)1((4fluorophenyl)sulfonyl)piperidine4carboxamide
N((2S)1(cyclopentylamino)4methylsulfanyl1oxobutan2yl)1(4fluorophenyl)sulfonylpiperidine4carboxamide
ZINC000013690639
ZINC13690639

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Available files

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