Vitas-M small molecule compound

ethyl (2Z)-5-(3-bromo-4-methoxyphenyl)-7-methyl-3-oxo-2-(pyridin-3-ylmethylidene)-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate

Catalog ID
STK804755
SMILES CCOC(=O)C1=C(C)N=c2n(C1c1ccc(c(c1)Br)OC)c(=O)/c(=C/c1cccnc1)/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 C23H20BrN3O4S MW 514.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H20BrN3O4S/c1-4-31-22(29)19-13(2)26-23-27(20(19)15-7-8-17(30-3)16(24)11-15)21(28)18(32-23)10-14-6-5-9-25-12-14/h5-12,20H,4H2,1-3H3/b18-10-
InChIKey
VTBOHUPVNGKJPL-ZDLGFXPLSA-N
Synonyms

(Z)ethyl5(3bromo4methoxyphenyl)7methyl3oxo2(pyridin3ylmethylene)35dihydro2Hthiazolo(32a)pyrimidine6carboxylate
CCOC(=O)C1=C(C)N=c2n(C1c1ccc(c(c1)Br)OC)c(=O)c(=Cc1cccnc1)s2
CCOC(=O)C1=C(N=C2N(C1C3=CC(=C(C=C3)OC)Br)C(=O)C(=CC4=CN=CC=C4)S2)C
ethyl(2Z)5(3bromo4methoxyphenyl)7methyl3oxo2(pyridin3ylmethylidene)23dihydro5H(13)thiazolo(32a)pyrimidine6carboxylate
ETHYL(2Z)5(3BROMO4METHOXYPHENYL)7METHYL3OXO2(PYRIDIN3YLMETHYLIDENE)5H(13)THIAZOLO(32A)PYRIMIDINE6CARBOXYLATE
ETHYL5(3BROMO4METHOXYPHENYL)7METHYL3OXO2(3PYRIDINYLMETHYLENE)23DIHYDRO5H(13)THIAZOLO(32A)PYRIMIDINE6CARBOXYLATE
InChI=1SC23H20BrN3O4Sc143122(29)1913(2)262327(20(19)157817(303)16(24)1115)21(28)18(3223)1014659251214h51220H4H213H3b1810
MFCD02071359
ZINC000008407219
ZINC000008407223

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Available files

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