Vitas-M small molecule compound

prop-2-en-1-yl (2Z)-5-(3,4-dimethoxyphenyl)-7-methyl-3-oxo-2-(thiophen-2-ylmethylidene)-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate

Catalog ID
STK534200
SMILES C=CCOC(=O)C1=C(C)N=c2n(C1c1ccc(c(c1)OC)OC)c(=O)/c(=C/c1cccs1)/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 C24H22N2O5S2 MW 482.58 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H22N2O5S2/c1-5-10-31-23(28)20-14(2)25-24-26(22(27)19(33-24)13-16-7-6-11-32-16)21(20)15-8-9-17(29-3)18(12-15)30-4/h5-9,11-13,21H,1,10H2,2-4H3/b19-13-
InChIKey
FLCBPPBQFCRMSA-UYRXBGFRSA-N
Synonyms
372497-56-8
(Z)allyl5(34dimethoxyphenyl)7methyl3oxo2(thiophen2ylmethylene)35dihydro2Hthiazolo(32a)pyrimidine6carboxylate
372497568
C=CCOC(=O)C1=C(C)N=c2n(C1c1ccc(c(c1)OC)OC)c(=O)c(=Cc1cccs1)s2
CC1=C(C(N2C(=O)C(=CC3=CC=CS3)SC2=N1)C4=CC(=C(C=C4)OC)OC)C(=O)OCC=C
InChI=1SC24H22N2O5S2c15103123(28)2014(2)252426(22(27)19(3324)131676113216)21(20)158917(293)18(1215)304h59111321H110H224H3b1913
MFCD01943226
prop2en1yl(2Z)5(34dimethoxyphenyl)7methyl3oxo2(thiophen2ylmethylidene)23dihydro5H(13)thiazolo(32a)pyrimidine6carboxylate
PROP2ENYL(2Z)5(34DIMETHOXYPHENYL)7METHYL3OXO2(THIOPHEN2YLMETHYLIDENE)5H(13)THIAZOLO(32A)PYRIMIDINE6CARBOXYLATE
ZINC000002277018
ZINC000002277020

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Available files

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