Vitas-M small molecule compound

[(5S)-3-[2-(2-amino-2-oxoethoxy)phenyl]-5-(2,3-dihydro-1,4-benzodioxin-6-ylcarbamoyl)-4,5-dihydro-1,2-oxazol-5-yl]acetic acid

Catalog ID
STK596054
SMILES NC(=O)COc1ccccc1C1=NO[C@@](C1)(CC(=O)O)C(=O)Nc1ccc2c(c1)OCCO2

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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 C22H21N3O8 MW 455.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H21N3O8/c23-19(26)12-32-16-4-2-1-3-14(16)15-10-22(33-25-15,11-20(27)28)21(29)24-13-5-6-17-18(9-13)31-8-7-30-17/h1-6,9H,7-8,10-12H2,(H2,23,26)(H,24,29)(H,27,28)/t22-/m0/s1
InChIKey
ZFONGKRAOKONCZ-QFIPXVFZSA-N
Synonyms
1212209-70-5
((5S)3(2(2amino2oxoethoxy)phenyl)5(23dihydro14benzodioxin6ylcarbamoyl)45dihydro12oxazol5yl)aceticacid
(S)2(3(2(2amino2oxoethoxy)phenyl)5((23dihydrobenzo(b)(14)dioxin6yl)carbamoyl)45dihydroisoxazol5yl)aceticacid
1212209705
2((5S)3(2(2amino2oxoethoxy)phenyl)5(23dihydro14benzodioxin6ylcarbamoyl)4H12oxazol5yl)aceticacid
C1COC2=C(O1)C=CC(=C2)NC(=O)C3(CC(=NO3)C4=CC=CC=C4OCC(=O)N)CC(=O)O
InChI=1SC22H21N3O8c2319(26)123216421314(16)151022(3325151120(27)28)21(29)2413561718(913)31873017h169H781012H2(H22326)(H2429)(H2728)t22m0s1
MFCD08284551
NC(=O)COc1ccccc1C1=NO(C@@)(C1)(CC(=O)O)C(=O)Nc1ccc2c(c1)OCCO2
ZINC000013591691
ZINC13591691

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Available files

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