Vitas-M small molecule compound
methyl 2-[1-(4-butoxy-3-methoxyphenyl)-3,9-dioxo-3,9-dihydrochromeno[2,3-c]pyrrol-2(1H)-yl]-4-methyl-1,3-thiazole-5-carboxylate
Catalog ID
STK817517
SMILES CCCCOc1ccc(cc1OC)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 C28H26N2O7S MW 534.59 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H26N2O7S/c1-5-6-13-36-19-12-11-16(14-20(19)34-3)22-21-23(31)17-9-7-8-10-18(17)37-24(21)26(32)30(22)28-29-15(2)25(38-28)27(33)35-4/h7-12,14,22H,5-6,13H2,1-4H3InChIKey
LNKAJAJZOHTZLN-UHFFFAOYSA-NSynonyms
CCCCOC1=C(C=C(C=C1)C2C3=C(C(=O)N2C4=NC(=C(S4)C(=O)OC)C)OC5=CC=CC=C5C3=O)OC
InChI=1SC28H26N2O7Sc156133619121116(1420(19)343)222123(31)179781018(17)3724(21)26(32)30(22)282915(2)25(3828)27(33)354h7121422H5613H214H3
METHYL2(1(4BUTOXY3METHOXYPHENYL)39DIOXO1HCHROMENO(23C)PYRROL2YL)4METHYL13THIAZOLE5CARBOXYLATE
methyl2(1(4butoxy3methoxyphenyl)39dioxo39dihydrochromeno(23c)pyrrol2(1H)yl)4methyl13thiazole5carboxylate
MFCD06289373
ZINC000003643305
ZINC000003643307
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