Vitas-M small molecule compound

{(5S)-5-[(5-chloro-2-methoxyphenyl)carbamoyl]-3-[(E)-2-phenylethenyl]-4,5-dihydro-1,2-oxazol-5-yl}acetic acid

Catalog ID
STK611106
SMILES COc1ccc(cc1NC(=O)[C@@]1(ON=C(C1)/C=C/c1ccccc1)CC(=O)O)Cl

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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 C21H19ClN2O5 MW 414.85 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H19ClN2O5/c1-28-18-10-8-15(22)11-17(18)23-20(27)21(13-19(25)26)12-16(24-29-21)9-7-14-5-3-2-4-6-14/h2-11H,12-13H2,1H3,(H,23,27)(H,25,26)/b9-7+/t21-/m0/s1
InChIKey
YMWPWPXRWQVXBS-OEAKIKGJSA-N
Synonyms
1014086-59-9
((5S)5((5chloro2methoxyphenyl)carbamoyl)3((E)2phenylethenyl)45dihydro12oxazol5yl)aceticacid
(SE)2(5((5chloro2methoxyphenyl)carbamoyl)3styryl45dihydroisoxazol5yl)aceticacid
1014086599
2((5S)5((5chloro2methoxyphenyl)carbamoyl)3((E)2phenylethenyl)4H12oxazol5yl)aceticacid
COC1=C(C=C(C=C1)Cl)NC(=O)C2(CC(=NO2)C=CC3=CC=CC=C3)CC(=O)O
COc1ccc(cc1NC(=O)(C@@)1(ON=C(C1)C=Cc1ccccc1)CC(=O)O)Cl
InChI=1SC21H19ClN2O5c1281810815(22)1117(18)2320(27)21(1319(25)26)1216(242921)97145324614h211H1213H21H3(H2327)(H2526)b97+t21m0s1
MFCD08289008
ZINC000006756878
ZINC6756878

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Available files

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