Vitas-M small molecule compound
methyl 2-{[(7-tert-butyl-3-oxo-2,3-dihydro-4H-1,4-benzoxazin-4-yl)acetyl]amino}benzoate
Catalog ID
STK985383
SMILES COC(=O)c1ccccc1NC(=O)CN1C(=O)COc2c1ccc(c2)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 C22H24N2O5 MW 396.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H24N2O5/c1-22(2,3)14-9-10-17-18(11-14)29-13-20(26)24(17)12-19(25)23-16-8-6-5-7-15(16)21(27)28-4/h5-11H,12-13H2,1-4H3,(H,23,25)InChIKey
VGCBVBUOHAALDQ-UHFFFAOYSA-NSynonyms
CC(C)(C)C1=CC2=C(C=C1)N(C(=O)CO2)CC(=O)NC3=CC=CC=C3C(=O)OC
InChI=1SC22H24N2O5c122(23)149101718(1114)291320(26)24(17)1219(25)2316865715(16)21(27)284h511H1213H214H3(H2325)
methyl2(((7tertbutyl3oxo23dihydro4H14benzoxazin4yl)acetyl)amino)benzoate
methyl2((2(7tertbutyl3oxo14benzoxazin4yl)acetyl)amino)benzoate
MFCD18182368
ZINC000051316182
ZINC51316182
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