Vitas-M small molecule compound

ethyl (2Z)-2-(2-ethoxybenzylidene)-5-(3-methoxyphenyl)-3-oxo-7-phenyl-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate

Catalog ID
STL164267
SMILES CCOC(=O)C1=C(N=c2n(C1c1cccc(c1)OC)c(=O)/c(=C/c1ccccc1OCC)/s2)c1ccccc1

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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 C31H28N2O5S MW 540.64 g/mol Purity >90% as per NMR
InChI
InChI=1S/C31H28N2O5S/c1-4-37-24-17-10-9-14-21(24)19-25-29(34)33-28(22-15-11-16-23(18-22)36-3)26(30(35)38-5-2)27(32-31(33)39-25)20-12-7-6-8-13-20/h6-19,28H,4-5H2,1-3H3/b25-19-
InChIKey
IHAOMXWIEYCJPL-PLRJNAJWSA-N
Synonyms

CCOC(=O)C1=C(N=c2n(C1c1cccc(c1)OC)c(=O)c(=Cc1ccccc1OCC)s2)c1ccccc1
CCOC1=CC=CC=C1C=C2C(=O)N3C(C(=C(N=C3S2)C4=CC=CC=C4)C(=O)OCC)C5=CC(=CC=C5)OC
ETHYL(2Z)2((2ETHOXYPHENYL)METHYLIDENE)5(3METHOXYPHENYL)3OXO7PHENYL5H(13)THIAZOLO(32A)PYRIMIDINE6CARBOXYLATE
ethyl(2Z)2(2ethoxybenzylidene)5(3methoxyphenyl)3oxo7phenyl23dihydro5H(13)thiazolo(32a)pyrimidine6carboxylate
ETHYL2(2ETHOXYBENZYLIDENE)5(3METHOXYPHENYL)3OXO7PHENYL23DIHYDRO5H(13)THIAZOLO(32A)PYRIMIDINE6CARBOXYLATE
InChI=1SC31H28N2O5Sc143724171091421(24)192529(34)3328(2215111623(1822)363)26(30(35)3852)27(3231(33)3925)20127681320h61928H45H213H3b2519
MFCD02951664
ZINC000002049621
ZINC000002049623

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.