Vitas-M small molecule compound
methyl 2-[3,9-dioxo-1-(3-phenoxyphenyl)-3,9-dihydrochromeno[2,3-c]pyrrol-2(1H)-yl]-4-methyl-1,3-thiazole-5-carboxylate
Catalog ID
STK800746
SMILES COC(=O)c1sc(nc1C)N1C(=O)c2c(C1c1cccc(c1)Oc1ccccc1)c(=O)c1c(o2)cccc1
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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 C29H20N2O6S MW 524.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H20N2O6S/c1-16-26(28(34)35-2)38-29(30-16)31-23(17-9-8-12-19(15-17)36-18-10-4-3-5-11-18)22-24(32)20-13-6-7-14-21(20)37-25(22)27(31)33/h3-15,23H,1-2H3InChIKey
GKAWLHSVVJLCPC-UHFFFAOYSA-NSynonyms
CC1=C(SC(=N1)N2C(C3=C(C2=O)OC4=CC=CC=C4C3=O)C5=CC(=CC=C5)OC6=CC=CC=C6)C(=O)OC
InChI=1SC29H20N2O6Sc11626(28(34)352)3829(3016)3123(17981219(1517)3618104351118)2224(32)2013671421(20)3725(22)27(31)33h31523H12H3
METHYL2(39DIOXO1(3PHENOXYPHENYL)1HCHROMENO(23C)PYRROL2YL)4METHYL13THIAZOLE5CARBOXYLATE
methyl2(39dioxo1(3phenoxyphenyl)39dihydrochromeno(23c)pyrrol2(1H)yl)4methyl13thiazole5carboxylate
MFCD06289360
ZINC000003643270
ZINC000003643272
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