Vitas-M small molecule compound
{(5S)-3-[2-(2-amino-2-oxoethoxy)phenyl]-5-[(5-chloro-2-methoxyphenyl)carbamoyl]-4,5-dihydro-1,2-oxazol-5-yl}acetic acid
Catalog ID
STK600867
SMILES COc1ccc(cc1NC(=O)[C@@]1(ON=C(C1)c1ccccc1OCC(=O)N)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 C21H20ClN3O7 MW 461.86 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H20ClN3O7/c1-30-17-7-6-12(22)8-14(17)24-20(29)21(10-19(27)28)9-15(25-32-21)13-4-2-3-5-16(13)31-11-18(23)26/h2-8H,9-11H2,1H3,(H2,23,26)(H,24,29)(H,27,28)/t21-/m0/s1InChIKey
VCMRKMYIAAUOKB-NRFANRHFSA-NSynonyms
1013752-66-3((5S)3(2(2amino2oxoethoxy)phenyl)5((5chloro2methoxyphenyl)carbamoyl)45dihydro12oxazol5yl)aceticacid
(S)2(3(2(2amino2oxoethoxy)phenyl)5((5chloro2methoxyphenyl)carbamoyl)45dihydroisoxazol5yl)aceticacid
1013752663
2((5S)3(2(2amino2oxoethoxy)phenyl)5((5chloro2methoxyphenyl)carbamoyl)4H12oxazol5yl)aceticacid
COC1=C(C=C(C=C1)Cl)NC(=O)C2(CC(=NO2)C3=CC=CC=C3OCC(=O)N)CC(=O)O
COc1ccc(cc1NC(=O)(C@@)1(ON=C(C1)c1ccccc1OCC(=O)N)CC(=O)O)Cl
InChI=1SC21H20ClN3O7c130177612(22)814(17)2420(29)21(1019(27)28)915(253221)13423516(13)311118(23)26h28H911H21H3(H22326)(H2429)(H2728)t21m0s1
MFCD08289223
ZINC000009410168
ZINC9410168
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