Vitas-M small molecule compound
benzyl 5-[4-(benzyloxy)-3-methoxyphenyl]-2-ethyl-7-methyl-3-oxo-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
Catalog ID
STK801142
SMILES CCC1SC2=NC(=C(C(N2C1=O)c1ccc(c(c1)OC)OCc1ccccc1)C(=O)OCc1ccccc1)C
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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 C31H30N2O5S MW 542.66 g/mol Purity >90% as per NMR
InChI
InChI=1S/C31H30N2O5S/c1-4-26-29(34)33-28(23-15-16-24(25(17-23)36-3)37-18-21-11-7-5-8-12-21)27(20(2)32-31(33)39-26)30(35)38-19-22-13-9-6-10-14-22/h5-17,26,28H,4,18-19H2,1-3H3InChIKey
WAWCZSMBOARKGA-UHFFFAOYSA-NSynonyms
benzyl2ethyl5(3methoxy4phenylmethoxyphenyl)7methyl3oxo5H(13)thiazolo(32a)pyrimidine6carboxylate
benzyl5(4(benzyloxy)3methoxyphenyl)2ethyl7methyl3oxo23dihydro5H(13)thiazolo(32a)pyrimidine6carboxylate
CCC1C(=O)N2C(C(=C(N=C2S1)C)C(=O)OCC3=CC=CC=C3)C4=CC(=C(C=C4)OCC5=CC=CC=C5)OC
InChI=1SC31H30N2O5Sc142629(34)3328(23151624(25(1723)363)371821117581221)27(20(2)3231(33)3926)30(35)3819221396101422h5172628H41819H213H3
MFCD06651127
ZINC000098047243
ZINC000098047246
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