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

Catalog ID
STL164282
SMILES CCOC(=O)C1=C(N=c2n(C1c1ccc3c(c1)OCO3)c(=O)/c(=C/c1ccc3c(c1)OCCO3)/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 C31H24N2O7S MW 568.61 g/mol Purity >90% as per NMR
InChI
InChI=1S/C31H24N2O7S/c1-2-36-30(35)26-27(19-6-4-3-5-7-19)32-31-33(28(26)20-9-11-22-24(16-20)40-17-39-22)29(34)25(41-31)15-18-8-10-21-23(14-18)38-13-12-37-21/h3-11,14-16,28H,2,12-13,17H2,1H3/b25-15-
InChIKey
WRVKQMKLHZFGRH-MYYYXRDXSA-N
Synonyms

CCOC(=O)C1=C(N=c2n(C1c1ccc3c(c1)OCO3)c(=O)c(=Cc1ccc3c(c1)OCCO3)s2)c1ccccc1
CCOC(=O)C1=C(N=C2N(C1C3=CC4=C(C=C3)OCO4)C(=O)C(=CC5=CC6=C(C=C5)OCCO6)S2)C7=CC=CC=C7
ethyl(2Z)5(13benzodioxol5yl)2(23dihydro14benzodioxin6ylmethylidene)3oxo7phenyl23dihydro5H(13)thiazolo(32a)pyrimidine6carboxylate
ETHYL(2Z)5(13BENZODIOXOL5YL)2(23DIHYDRO14BENZODIOXIN6YLMETHYLIDENE)3OXO7PHENYL5H(13)THIAZOLO(32A)PYRIMIDINE6CARBOXYLATE
ETHYL5(13BENZODIOXOL5YL)2(23DIHYDRO14BENZODIOXIN6YLMETHYLENE)3OXO7PHENYL23DIHYDRO5H(13)THIAZOLO(32A)PYRIMIDINE6CARBOXYLATE
InChI=1SC31H24N2O7Sc123630(35)2627(196435719)323133(28(26)209112224(1620)40173922)29(34)25(4131)15188102123(1418)3813123721h311141628H2121317H21H3b2515
MFCD03082231
ZINC000002162581
ZINC000002162584

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Available files

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