Vitas-M small molecule compound
2-methoxyethyl (2E)-2-benzylidene-7-methyl-3-oxo-5-(4-propoxyphenyl)-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
Catalog ID
STK810653
SMILES COCCOC(=O)C1=C(C)N=c2n(C1c1ccc(cc1)OCCC)c(=O)/c(=C\c1ccccc1)/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 C27H28N2O5S MW 492.60 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H28N2O5S/c1-4-14-33-21-12-10-20(11-13-21)24-23(26(31)34-16-15-32-3)18(2)28-27-29(24)25(30)22(35-27)17-19-8-6-5-7-9-19/h5-13,17,24H,4,14-16H2,1-3H3/b22-17+InChIKey
QQAOQKAYPBGCIC-OQKWZONESA-NSynonyms
2methoxyethyl(2E)2benzylidene7methyl3oxo5(4propoxyphenyl)23dihydro5H(13)thiazolo(32a)pyrimidine6carboxylate
2methoxyethyl(2E)2benzylidene7methyl3oxo5(4propoxyphenyl)5H(13)thiazolo(32a)pyrimidine6carboxylate
2METHOXYETHYL2BENZYLIDENE7METHYL3OXO5(4PROPOXYPHENYL)23DIHYDRO5H(13)THIAZOLO(32A)PYRIMIDINE6CARBOXYLATE
CCCOC1=CC=C(C=C1)C2C(=C(N=C3N2C(=O)C(=CC4=CC=CC=C4)S3)C)C(=O)OCCOC
COCCOC(=O)C1=C(C)N=c2n(C1c1ccc(cc1)OCCC)c(=O)c(=Cc1ccccc1)s2
InChI=1SC27H28N2O5Sc14143321121020(111321)2423(26(31)341615323)18(2)282729(24)25(30)22(3527)17198657919h5131724H41416H213H3b2217+
MFCD03933000
ZINC000016701192
ZINC000016701195
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