Vitas-M small molecule compound

ethyl (2Z)-5-(3,4-dimethoxyphenyl)-7-methyl-2-[3-(naphthalen-1-ylmethoxy)benzylidene]-3-oxo-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate

Catalog ID
STK325751
SMILES CCOC(=O)C1=C(C)N=c2n(C1c1ccc(c(c1)OC)OC)c(=O)/c(=C/c1cccc(c1)OCc1cccc3c1cccc3)/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 C36H32N2O6S MW 620.73 g/mol Purity >90% as per NMR
InChI
InChI=1S/C36H32N2O6S/c1-5-43-35(40)32-22(2)37-36-38(33(32)25-16-17-29(41-3)30(20-25)42-4)34(39)31(45-36)19-23-10-8-14-27(18-23)44-21-26-13-9-12-24-11-6-7-15-28(24)26/h6-20,33H,5,21H2,1-4H3/b31-19-
InChIKey
DCJCSSQXULUBOD-DXJNIWACSA-N
Synonyms

CCOC(=O)C1=C(C)N=c2n(C1c1ccc(c(c1)OC)OC)c(=O)c(=Cc1cccc(c1)OCc1cccc3c1cccc3)s2
CCOC(=O)C1=C(N=C2N(C1C3=CC(=C(C=C3)OC)OC)C(=O)C(=CC4=CC(=CC=C4)OCC5=CC=CC6=CC=CC=C65)S2)C
ETHYL(2Z)5(34DIMETHOXYPHENYL)7METHYL2((3(NAPHTHALEN1YLMETHOXY)PHENYL)METHYLIDENE)3OXO5H(13)THIAZOLO(32A)PYRIMIDINE6CARBOXYLATE
ETHYL(2Z)5(34DIMETHOXYPHENYL)7METHYL2(3(NAPHTHALEN1YLMETHOXY)BENZYLIDENE)3OXO23DIHYDRO5H(13)THIAZOLO(32A)PYRIMIDINE6CARBOXYLATE
InChI=1SC36H32N2O6Sc154335(40)3222(2)373638(33(32)25161729(413)30(2025)424)34(39)31(4536)19231081427(1823)442126139122411671528(24)26h62033H521H214H3b3119
MFCD01592297
ZINC000100617696
ZINC000100617697

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Available files

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