Vitas-M small molecule compound

methyl 4-{[(3-methyl-4-oxo-4,5,6,7-tetrahydro-1-benzofuran-2-yl)carbonyl]amino}benzoate

Catalog ID
STK582336
SMILES COC(=O)c1ccc(cc1)NC(=O)c1oc2c(c1C)C(=O)CCC2

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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 C18H17NO5 MW 327.34 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H17NO5/c1-10-15-13(20)4-3-5-14(15)24-16(10)17(21)19-12-8-6-11(7-9-12)18(22)23-2/h6-9H,3-5H2,1-2H3,(H,19,21)
InChIKey
GNYNNAFWOCKFDC-UHFFFAOYSA-N
Synonyms
879914-43-9
879914439
CC1=C(OC2=C1C(=O)CCC2)C(=O)NC3=CC=C(C=C3)C(=O)OC
InChI=1SC18H17NO5c1101513(20)43514(15)2416(10)17(21)19128611(7912)18(22)232h69H35H212H3(H1921)
methyl4(((3methyl4oxo4567tetrahydro1benzofuran2yl)carbonyl)amino)benzoate
METHYL4((3METHYL4OXO567TRIHYDROBENZO(21D)FURAN2YL)CARBONYLAMINO)BENZOATE
METHYL4((3METHYL4OXO67DIHYDRO5H1BENZOFURAN2CARBONYL)AMINO)BENZOATE
methyl4(3methyl4oxo4567tetrahydrobenzofuran2carboxamido)benzoate
MFCD06643741
ZINC000005246260
ZINC05246260
ZINC5246260

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Available files

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