Vitas-M small molecule compound
[(5S)-5-[(2,4-dimethylphenyl)carbamoyl]-3-(4-methoxyphenyl)-4,5-dihydro-1,2-oxazol-5-yl]acetic acid
Catalog ID
STK583969
SMILES COc1ccc(cc1)C1=NO[C@@](C1)(CC(=O)O)C(=O)Nc1ccc(cc1C)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 C21H22N2O5 MW 382.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H22N2O5/c1-13-4-9-17(14(2)10-13)22-20(26)21(12-19(24)25)11-18(23-28-21)15-5-7-16(27-3)8-6-15/h4-10H,11-12H2,1-3H3,(H,22,26)(H,24,25)/t21-/m0/s1InChIKey
ORRWBHUYPWWCQM-NRFANRHFSA-NSynonyms
1212150-61-2((5S)5((24dimethylphenyl)carbamoyl)3(4methoxyphenyl)45dihydro12oxazol5yl)aceticacid
(S)2(5((24dimethylphenyl)carbamoyl)3(4methoxyphenyl)45dihydroisoxazol5yl)aceticacid
1212150612
2((5S)5((24DIMETHYLPHENYL)CARBAMOYL)3(4METHOXYPHENYL)4H12OXAZOL5YL)ACETICACID
CC1=CC(=C(C=C1)NC(=O)C2(CC(=NO2)C3=CC=C(C=C3)OC)CC(=O)O)C
COc1ccc(cc1)C1=NO(C@@)(C1)(CC(=O)O)C(=O)Nc1ccc(cc1C)C
InChI=1SC21H22N2O5c1134917(14(2)1013)2220(26)21(1219(24)25)1118(232821)155716(273)8615h410H1112H213H3(H2226)(H2425)t21m0s1
MFCD08284619
ZINC000005452067
ZINC5452067
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