Vitas-M small molecule compound
methyl 2-{methyl[(3,6,6-trimethyl-4-oxo-4,5,6,7-tetrahydro-1-benzofuran-2-yl)carbonyl]amino}benzoate
Catalog ID
STK580491
SMILES COC(=O)c1ccccc1N(C(=O)c1oc2c(c1C)C(=O)CC(C2)(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 C21H23NO5 MW 369.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H23NO5/c1-12-17-15(23)10-21(2,3)11-16(17)27-18(12)19(24)22(4)14-9-7-6-8-13(14)20(25)26-5/h6-9H,10-11H2,1-5H3InChIKey
FOMIOYKPZSUCBC-UHFFFAOYSA-NSynonyms
881041-97-0881041970
CC1=C(OC2=C1C(=O)CC(C2)(C)C)C(=O)N(C)C3=CC=CC=C3C(=O)OC
InChI=1SC21H23NO5c1121715(23)1021(23)1116(17)2718(12)19(24)22(4)14976813(14)20(25)265h69H1011H215H3
methyl2(methyl((366trimethyl4oxo4567tetrahydro1benzofuran2yl)carbonyl)amino)benzoate
METHYL2(METHYL(366TRIMETHYL4OXO57DIHYDRO1BENZOFURAN2CARBONYL)AMINO)BENZOATE
methyl2(N366tetramethyl4oxo4567tetrahydrobenzofuran2carboxamido)benzoate
METHYL2(NMETHYL(366TRIMETHYL4OXO(567TRIHYDROBENZO(21D)FURAN2YL))CARBONYLAMINO)BENZOATE
MFCD06650547
ZINC000005302810
ZINC05302810
ZINC5302810
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