Vitas-M small molecule compound

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

Catalog ID
STK809070
SMILES CCOC(=O)C1=C(C)N=c2n(C1c1ccc(cc1)C)c(=O)/c(=C/c1ccc3c(c1)OCO3)/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)17-8-5-14(2)6-9-17)23(28)20(33-25)12-16-7-10-18-19(11-16)32-13-31-18/h5-12,22H,4,13H2,1-3H3/b20-12-
InChIKey
WBLHYEJBDQXYTL-NDENLUEZSA-N
Synonyms

CCOC(=O)C1=C(C)N=c2n(C1c1ccc(cc1)C)c(=O)c(=Cc1ccc3c(c1)OCO3)s2
CCOC(=O)C1=C(N=C2N(C1C3=CC=C(C=C3)C)C(=O)C(=CC4=CC5=C(C=C4)OCO5)S2)C
ethyl(2Z)2(13benzodioxol5ylmethylidene)7methyl5(4methylphenyl)3oxo23dihydro5H(13)thiazolo(32a)pyrimidine6carboxylate
ETHYL(2Z)2(13BENZODIOXOL5YLMETHYLIDENE)7METHYL5(4METHYLPHENYL)3OXO5H(13)THIAZOLO(32A)PYRIMIDINE6CARBOXYLATE
ETHYL2(2H13BENZODIOXOL5YLMETHYLIDENE)7METHYL5(4METHYLPHENYL)3OXO2H3H5HPYRIMIDO(21B)(13)THIAZOLE6CARBOXYLATE
ETHYL2(2HBENZO(34D)13DIOXOLAN5YLMETHYLENE)7METHYL5(4METHYLPHENYL)3OXO45DIHYDRO13THIAZOLIDINO(32A)PYRIMIDINE6CARBOXYLATE
InChI=1SC25H22N2O5Sc143024(29)2115(3)262527(22(21)178514(2)6917)23(28)20(3325)12167101819(1116)32133118h51222H413H213H3b2012
MFCD01611691
ZINC000000728902
ZINC000000728907

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Available files

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