Vitas-M small molecule compound
methyl 4-{(E)-[2-(4-tert-butylphenyl)-5-oxo-1,3-oxazol-4(5H)-ylidene]methyl}benzoate
Catalog ID
STK710206
SMILES COC(=O)c1ccc(cc1)/C=C\1/N=C(OC1=O)c1ccc(cc1)C(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 C22H21NO4 MW 363.41 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H21NO4/c1-22(2,3)17-11-9-15(10-12-17)19-23-18(21(25)27-19)13-14-5-7-16(8-6-14)20(24)26-4/h5-13H,1-4H3/b18-13+InChIKey
MVOLQCWWQDJIEV-QGOAFFKASA-NSynonyms
(Z)methyl4((2(4(tertbutyl)phenyl)5oxooxazol4(5H)ylidene)methyl)benzoate
CC(C)(C)C1=CC=C(C=C1)C2=NC(=CC3=CC=C(C=C3)C(=O)OC)C(=O)O2
COC(=O)c1ccc(cc1)C=C1N=C(OC1=O)c1ccc(cc1)C(C)(C)C
InChI=1SC22H21NO4c122(23)1711915(101217)192318(21(25)2719)13145716(8614)20(24)264h513H14H3b1813+
methyl4((E)(2(4tertbutylphenyl)5oxo13oxazol4(5H)ylidene)methyl)benzoate
METHYL4((E)(2(4TERTBUTYLPHENYL)5OXO13OXAZOL4YLIDENE)METHYL)BENZOATE
MFCD00617683
ZINC000000704946
ZINC00704946
ZINC704946
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