Vitas-M small molecule compound

methyl 2-{1-[3-(benzyloxy)phenyl]-3,9-dioxo-3,9-dihydrochromeno[2,3-c]pyrrol-2(1H)-yl}-4-methyl-1,3-thiazole-5-carboxylate

Catalog ID
STK800745
SMILES COC(=O)c1sc(nc1C)N1C(=O)c2c(C1c1cccc(c1)OCc1ccccc1)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 C30H22N2O6S MW 538.58 g/mol Purity >90% as per NMR
InChI
InChI=1S/C30H22N2O6S/c1-17-27(29(35)36-2)39-30(31-17)32-24(19-11-8-12-20(15-19)37-16-18-9-4-3-5-10-18)23-25(33)21-13-6-7-14-22(21)38-26(23)28(32)34/h3-15,24H,16H2,1-2H3
InChIKey
GHQVBFMZCLNTKG-UHFFFAOYSA-N
Synonyms

CC1=C(SC(=N1)N2C(C3=C(C2=O)OC4=CC=CC=C4C3=O)C5=CC(=CC=C5)OCC6=CC=CC=C6)C(=O)OC
InChI=1SC30H22N2O6Sc11727(29(35)362)3930(3117)3224(191181220(1519)37161894351018)2325(33)2113671422(21)3826(23)28(32)34h31524H16H212H3
methyl2(1(3(benzyloxy)phenyl)39dioxo39dihydrochromeno(23c)pyrrol2(1H)yl)4methyl13thiazole5carboxylate
METHYL2(39DIOXO1(3PHENYLMETHOXYPHENYL)1HCHROMENO(23C)PYRROL2YL)4METHYL13THIAZOLE5CARBOXYLATE
MFCD06289387
ZINC000003643350
ZINC000003643352

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Available files

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