Vitas-M small molecule compound
benzyl 5-(3,4-diethoxyphenyl)-2-ethyl-7-methyl-3-oxo-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
Catalog ID
STK703927
SMILES CCOc1cc(ccc1OCC)C1N2C(=NC(=C1C(=O)OCc1ccccc1)C)SC(C2=O)CC
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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 C27H30N2O5S MW 494.61 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H30N2O5S/c1-5-22-25(30)29-24(19-13-14-20(32-6-2)21(15-19)33-7-3)23(17(4)28-27(29)35-22)26(31)34-16-18-11-9-8-10-12-18/h8-15,22,24H,5-7,16H2,1-4H3InChIKey
BFLYIYCHPJHDNP-UHFFFAOYSA-NSynonyms
benzyl5(34diethoxyphenyl)2ethyl7methyl3oxo23dihydro5H(13)thiazolo(32a)pyrimidine6carboxylate
BENZYL5(34DIETHOXYPHENYL)2ETHYL7METHYL3OXO5H(13)THIAZOLO(32A)PYRIMIDINE6CARBOXYLATE
CCC1C(=O)N2C(C(=C(N=C2S1)C)C(=O)OCC3=CC=CC=C3)C4=CC(=C(C=C4)OCC)OCC
InChI=1SC27H30N2O5Sc152225(30)2924(19131420(3262)21(1519)3373)23(17(4)2827(29)3522)26(31)3416181198101218h8152224H5716H214H3
MFCD04515229
ZINC000003636868
ZINC000003636873
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