Vitas-M small molecule compound
methyl 4-[2-(4-fluorobenzyl)-7-methyl-3,9-dioxo-1,2,3,9-tetrahydrochromeno[2,3-c]pyrrol-1-yl]benzoate
Catalog ID
STK514727
SMILES COC(=O)c1ccc(cc1)C1N(Cc2ccc(cc2)F)C(=O)c2c1c(=O)c1c(o2)ccc(c1)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 C27H20FNO5 MW 457.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H20FNO5/c1-15-3-12-21-20(13-15)24(30)22-23(17-6-8-18(9-7-17)27(32)33-2)29(26(31)25(22)34-21)14-16-4-10-19(28)11-5-16/h3-13,23H,14H2,1-2H3InChIKey
CPMIVLPPXVQNMU-UHFFFAOYSA-NSynonyms
708283-25-4708283254
CC1=CC2=C(C=C1)OC3=C(C2=O)C(N(C3=O)CC4=CC=C(C=C4)F)C5=CC=C(C=C5)C(=O)OC
InChI=1SC27H20FNO5c1153122120(1315)24(30)2223(176818(9717)27(32)332)29(26(31)25(22)3421)141641019(28)11516h31323H14H212H3
METHYL4(2((4FLUOROPHENYL)METHYL)7METHYL39DIOXO1HCHROMENO(23C)PYRROL1YL)BENZOATE
methyl4(2(4fluorobenzyl)7methyl39dioxo1239tetrahydrochromeno(23c)pyrrol1yl)benzoate
MFCD05992535
ZINC000002860488
ZINC000002860489
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