Vitas-M small molecule compound

ethyl 2-ethyl-7-methyl-3-oxo-5-[4-(propan-2-yl)phenyl]-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate

Catalog ID
STK817135
SMILES CCOC(=O)C1=C(C)N=C2N(C1c1ccc(cc1)C(C)C)C(=O)C(S2)CC

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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 C21H26N2O3S MW 386.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H26N2O3S/c1-6-16-19(24)23-18(15-10-8-14(9-11-15)12(3)4)17(20(25)26-7-2)13(5)22-21(23)27-16/h8-12,16,18H,6-7H2,1-5H3
InChIKey
DJHNHVYSDRPWIT-UHFFFAOYSA-N
Synonyms

CCC1C(=O)N2C(C(=C(N=C2S1)C)C(=O)OCC)C3=CC=C(C=C3)C(C)C
ETHYL(2R5R)2ETHYL7METHYL3OXO5(4(PROPAN2YL)PHENYL)23DIHYDRO5H(13)THIAZOLO(32A)PYRIMIDINE6CARBOXYLATE
ETHYL(2S5R)2ETHYL7METHYL3OXO5(4(PROPAN2YL)PHENYL)23DIHYDRO5H(13)THIAZOLO(32A)PYRIMIDINE6CARBOXYLATE
ETHYL(2S5S)2ETHYL7METHYL3OXO5(4(PROPAN2YL)PHENYL)23DIHYDRO5H(13)THIAZOLO(32A)PYRIMIDINE6CARBOXYLATE
ethyl2ethyl7methyl3oxo5(4(propan2yl)phenyl)23dihydro5H(13)thiazolo(32a)pyrimidine6carboxylate
ETHYL2ETHYL7METHYL3OXO5(4PROPAN2YLPHENYL)5H(13)THIAZOLO(32A)PYRIMIDINE6CARBOXYLATE
InChI=1SC21H26N2O3Sc161619(24)2318(1510814(91115)12(3)4)17(20(25)2672)13(5)2221(23)2716h8121618H67H215H3
MFCD04446257
ZINC000002463405
ZINC000002463414

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Available files

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