Vitas-M small molecule compound

N-(2,3-dihydro-1,4-benzodioxin-6-yl)-N~2~-[(5-oxo-1-phenylpyrrolidin-3-yl)carbonyl]-L-valinamide

Catalog ID
STK652696
SMILES O=C(C1CN(C(=O)C1)c1ccccc1)N[C@H](C(=O)Nc1ccc2c(c1)OCCO2)C(C)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 C24H27N3O5 MW 437.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H27N3O5/c1-15(2)22(24(30)25-17-8-9-19-20(13-17)32-11-10-31-19)26-23(29)16-12-21(28)27(14-16)18-6-4-3-5-7-18/h3-9,13,15-16,22H,10-12,14H2,1-2H3,(H,25,30)(H,26,29)/t16?,22-/m0/s1
InChIKey
OPGLOLYUTULGIH-XLDIYJRPSA-N
Synonyms
1212465-68-3
1212465683
CC(C)C(C(=O)NC1=CC2=C(C=C1)OCCO2)NC(=O)C3CC(=O)N(C3)C4=CC=CC=C4
InChI=1SC24H27N3O5c115(2)22(24(30)2517891920(1317)3211103119)2623(29)161221(28)27(1416)186435718h3913151622H101214H212H3(H2530)(H2629)t16?22m0s1
MFCD18166414
N((2S)1(23dihydro14benzodioxin6ylamino)3methyl1oxobutan2yl)5oxo1phenylpyrrolidine3carboxamide
N((S)1((23dihydrobenzo(b)(14)dioxin6yl)amino)3methyl1oxobutan2yl)5oxo1phenylpyrrolidine3carboxamide
N(23dihydro14benzodioxin6yl)N~2~((5oxo1phenylpyrrolidin3yl)carbonyl)Lvalinamide
N(23DIHYDRO14BENZODIOXIN6YL)N2((5OXO1PHENYLPYRROLIDIN3YL)CARBONYL)LVALINAMIDE
O=C(C1CN(C(=O)C1)c1ccccc1)N(C@H)(C(=O)Nc1ccc2c(c1)OCCO2)C(C)C
ZINC000032094957
ZINC000032094960

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Available files

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