Vitas-M small molecule compound

ethyl (2Z)-5-(1,3-benzodioxol-5-yl)-7-methyl-2-(4-methylbenzylidene)-3-oxo-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate

Catalog ID
STK742440
SMILES CCOC(=O)C1=C(C)N=c2n(C1c1ccc3c(c1)OCO3)c(=O)/c(=C/c1ccc(cc1)C)/s2

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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 C25H22N2O5S MW 462.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H22N2O5S/c1-4-30-24(29)21-15(3)26-25-27(22(21)17-9-10-18-19(12-17)32-13-31-18)23(28)20(33-25)11-16-7-5-14(2)6-8-16/h5-12,22H,4,13H2,1-3H3/b20-11-
InChIKey
SLKAKHWYWAKSMO-JAIQZWGSSA-N
Synonyms

CCOC(=O)C1=C(C)N=c2n(C1c1ccc3c(c1)OCO3)c(=O)c(=Cc1ccc(cc1)C)s2
CCOC(=O)C1=C(N=C2N(C1C3=CC4=C(C=C3)OCO4)C(=O)C(=CC5=CC=C(C=C5)C)S2)C
ETHYL(2Z)5(13BENZODIOXOL5YL)7METHYL2((4METHYLPHENYL)METHYLIDENE)3OXO5H(13)THIAZOLO(32A)PYRIMIDINE6CARBOXYLATE
ethyl(2Z)5(13benzodioxol5yl)7methyl2(4methylbenzylidene)3oxo23dihydro5H(13)thiazolo(32a)pyrimidine6carboxylate
InChI=1SC25H22N2O5Sc143024(29)2115(3)262527(22(21)179101819(1217)32133118)23(28)20(3325)11167514(2)6816h51222H413H213H3b2011
MFCD01061692
ZINC000000714453
ZINC000000714455

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Available files

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