Vitas-M small molecule compound
methyl 2-{1-[4-(hexyloxy)phenyl]-3,9-dioxo-3,9-dihydrochromeno[2,3-c]pyrrol-2(1H)-yl}-4-methyl-1,3-thiazole-5-carboxylate
Catalog ID
STK516472
SMILES CCCCCCOc1ccc(cc1)C1N(c2nc(c(s2)C(=O)OC)C)C(=O)c2c1c(=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 C29H28N2O6S MW 532.62 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H28N2O6S/c1-4-5-6-9-16-36-19-14-12-18(13-15-19)23-22-24(32)20-10-7-8-11-21(20)37-25(22)27(33)31(23)29-30-17(2)26(38-29)28(34)35-3/h7-8,10-15,23H,4-6,9,16H2,1-3H3InChIKey
JBLNNAGOBYUHJM-UHFFFAOYSA-NSynonyms
CCCCCCOC1=CC=C(C=C1)C2C3=C(C(=O)N2C4=NC(=C(S4)C(=O)OC)C)OC5=CC=CC=C5C3=O
InChI=1SC29H28N2O6Sc14569163619141218(131519)232224(32)2010781121(20)3725(22)27(33)31(23)293017(2)26(3829)28(34)353h78101523H46916H213H3
methyl2(1(4(hexyloxy)phenyl)39dioxo39dihydrochromeno(23c)pyrrol2(1H)yl)4methyl13thiazole5carboxylate
METHYL2(1(4HEXOXYPHENYL)39DIOXO1HCHROMENO(23C)PYRROL2YL)4METHYL13THIAZOLE5CARBOXYLATE
MFCD06289398
ZINC000098046655
ZINC000098046656
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