Vitas-M small molecule compound

methyl [(5E)-5-{[1-(4-methoxyphenyl)-2,5-dimethyl-1H-pyrrol-3-yl]methylidene}-2,4-dioxo-1,3-thiazolidin-3-yl]acetate

Catalog ID
STK152273
SMILES COC(=O)CN1C(=O)S/C(=C/c2cc(n(c2C)c2ccc(cc2)OC)C)/C1=O

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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 C20H20N2O5S MW 400.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H20N2O5S/c1-12-9-14(13(2)22(12)15-5-7-16(26-3)8-6-15)10-17-19(24)21(20(25)28-17)11-18(23)27-4/h5-10H,11H2,1-4H3/b17-10+
InChIKey
DWDBUCZWSWXKKD-LICLKQGHSA-N
Synonyms

CC1=CC(=C(N1C2=CC=C(C=C2)OC)C)C=C3C(=O)N(C(=O)S3)CC(=O)OC
COC(=O)CN1C(=O)SC(=Cc2cc(n(c2C)c2ccc(cc2)OC)C)C1=O
InChI=1SC20H20N2O5Sc112914(13(2)22(12)155716(263)8615)101719(24)21(20(25)2817)1118(23)274h510H11H214H3b1710+
METHYL((5E)5((1(4METHOXYPHENYL)25DIMETHYL1HPYRROL3YL)METHYLIDENE)24DIOXO13THIAZOLIDIN3YL)ACETATE
METHYL2((5E)5((1(4METHOXYPHENYL)25DIMETHYLPYRROL3YL)METHYLIDENE)24DIOXO13THIAZOLIDIN3YL)ACETATE
MFCD03700072
ZINC000001018584
ZINC01018584
ZINC1018584

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Available files

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