Vitas-M small molecule compound

Catalog ID
STK619920
SMILES CCC([C@@H](C(=O)NCc1ccccc1)NC(=O)C1CCCN(C1)S(=O)(=O)c1ccc(cc1)F)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 C25H32FN3O4S MW 489.61 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H32FN3O4S/c1-3-18(2)23(25(31)27-16-19-8-5-4-6-9-19)28-24(30)20-10-7-15-29(17-20)34(32,33)22-13-11-21(26)12-14-22/h4-6,8-9,11-14,18,20,23H,3,7,10,15-17H2,1-2H3,(H,27,31)(H,28,30)/t18?,20?,23-/m0/s1
InChIKey
CHKRSOGVBMLJEQ-PXLSRWGNSA-N
Synonyms
956930-55-5
956930555
CCC((C@@H)(C(=O)NCc1ccccc1)NC(=O)C1CCCN(C1)S(=O)(=O)c1ccc(cc1)F)C
CCC(C)C(C(=O)NCC1=CC=CC=C1)NC(=O)C2CCCN(C2)S(=O)(=O)C3=CC=C(C=C3)F
InChI=1SC25H32FN3O4Sc1318(2)23(25(31)2716198546919)2824(30)201071529(1720)34(3233)22131121(26)121422h46891114182023H37101517H212H3(H2731)(H2830)t18?20?23m0s1
N((2S)1(benzylamino)3methyl1oxopentan2yl)1(4fluorophenyl)sulfonylpiperidine3carboxamide
N((2S3R)1(benzylamino)3methyl1oxopentan2yl)1((4fluorophenyl)sulfonyl)piperidine3carboxamide
ZINC000009184345
ZINC000013626065

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Available files

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