Vitas-M small molecule compound

prop-2-en-1-yl 5-(4-ethoxy-3-methoxyphenyl)-2,7-dimethyl-3-oxo-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate

Catalog ID
STK704786
SMILES C=CCOC(=O)C1=C(C)N=C2N(C1c1ccc(c(c1)OC)OCC)C(=O)C(S2)C

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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 C21H24N2O5S MW 416.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H24N2O5S/c1-6-10-28-20(25)17-12(3)22-21-23(19(24)13(4)29-21)18(17)14-8-9-15(27-7-2)16(11-14)26-5/h6,8-9,11,13,18H,1,7,10H2,2-5H3
InChIKey
DEPUGKQLRNCGKM-UHFFFAOYSA-N
Synonyms
620555-59-1
620555591
CCOC1=C(C=C(C=C1)C2C(=C(N=C3N2C(=O)C(S3)C)C)C(=O)OCC=C)OC
InChI=1SC21H24N2O5Sc16102820(25)1712(3)222123(19(24)13(4)2921)18(17)148915(2772)16(1114)265h689111318H1710H225H3
MFCD04446630
PROP2EN1YL(2R5S)5(4ETHOXY3METHOXYPHENYL)27DIMETHYL3OXO23DIHYDRO5H(13)THIAZOLO(32A)PYRIMIDINE6CARBOXYLATE
PROP2EN1YL(2S5R)5(4ETHOXY3METHOXYPHENYL)27DIMETHYL3OXO23DIHYDRO5H(13)THIAZOLO(32A)PYRIMIDINE6CARBOXYLATE
PROP2EN1YL(2S5S)5(4ETHOXY3METHOXYPHENYL)27DIMETHYL3OXO23DIHYDRO5H(13)THIAZOLO(32A)PYRIMIDINE6CARBOXYLATE
prop2en1yl5(4ethoxy3methoxyphenyl)27dimethyl3oxo23dihydro5H(13)thiazolo(32a)pyrimidine6carboxylate
PROP2ENYL5(4ETHOXY3METHOXYPHENYL)27DIMETHYL3OXO5H(13)THIAZOLO(32A)PYRIMIDINE6CARBOXYLATE
ZINC000002463640
ZINC000002463650

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Available files

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