Vitas-M small molecule compound

trans-N-{(2S)-1-[(2-hydroxyethyl)amino]-1-oxopropan-2-yl}-4-({[(4-methoxyphenyl)sulfonyl]amino}methyl)cyclohexanecarboxamide

Catalog ID
STK623947
SMILES OCCNC(=O)[C@@H](NC(=O)[C@@H]1CC[C@H](CC1)CNS(=O)(=O)c1ccc(cc1)OC)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 C20H31N3O6S MW 441.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H31N3O6S/c1-14(19(25)21-11-12-24)23-20(26)16-5-3-15(4-6-16)13-22-30(27,28)18-9-7-17(29-2)8-10-18/h7-10,14-16,22,24H,3-6,11-13H2,1-2H3,(H,21,25)(H,23,26)/t14-,15-,16-/m0/s1
InChIKey
CVWHCSFMTPRHHX-JYJNAYRXSA-N
Synonyms

(1r4S)N((S)1((2hydroxyethyl)amino)1oxopropan2yl)4((4methoxyphenylsulfonamido)methyl)cyclohexanecarboxamide
MFCD18246437
OCCNC(=O)(C@@H)(NC(=O)(C@@H)1CC(C@H)(CC1)CNS(=O)(=O)c1ccc(cc1)OC)C
transN((2S)1((2hydroxyethyl)amino)1oxopropan2yl)4((((4methoxyphenyl)sulfonyl)amino)methyl)cyclohexanecarboxamide
ZINC000245254868

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Available files

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