Vitas-M small molecule compound

methyl 4-({[(5E)-5-(4-methoxybenzylidene)-2,4-dioxo-1,3-thiazolidin-3-yl]methyl}amino)benzoate

Catalog ID
STK332414
SMILES COc1ccc(cc1)/C=C\1/SC(=O)N(C1=O)CNc1ccc(cc1)C(=O)OC

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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 C20H18N2O5S MW 398.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H18N2O5S/c1-26-16-9-3-13(4-10-16)11-17-18(23)22(20(25)28-17)12-21-15-7-5-14(6-8-15)19(24)27-2/h3-11,21H,12H2,1-2H3/b17-11+
InChIKey
PAYKLARAIJONBO-GZTJUZNOSA-N
Synonyms

COC1=CC=C(C=C1)C=C2C(=O)N(C(=O)S2)CNC3=CC=C(C=C3)C(=O)OC
COc1ccc(cc1)C=C1SC(=O)N(C1=O)CNc1ccc(cc1)C(=O)OC
InChI=1SC20H18N2O5Sc126169313(41016)111718(23)22(20(25)2817)1221157514(6815)19(24)272h31121H12H212H3b1711+
methyl4((((5E)5(4methoxybenzylidene)24dioxo13thiazolidin3yl)methyl)amino)benzoate
methyl4(((5E)5((4methoxyphenyl)methylidene)24dioxo13thiazolidin3yl)methylamino)benzoate
MFCD00351459
ZINC000018194982
ZINC18194982

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Available files

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