Vitas-M small molecule compound

ethyl (2Z)-5-(4-fluorophenyl)-7-methyl-2-{[5-(4-methylpiperazin-1-yl)furan-2-yl]methylidene}-3-oxo-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate

Catalog ID
STK984155
SMILES CCOC(=O)C1=C(C)N=c2n(C1c1ccc(cc1)F)c(=O)/c(=C/c1ccc(o1)N1CCN(CC1)C)/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 C26H27FN4O4S MW 510.59 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H27FN4O4S/c1-4-34-25(33)22-16(2)28-26-31(23(22)17-5-7-18(27)8-6-17)24(32)20(36-26)15-19-9-10-21(35-19)30-13-11-29(3)12-14-30/h5-10,15,23H,4,11-14H2,1-3H3/b20-15-
InChIKey
YAKACQBIFZKQDQ-HKWRFOASSA-N
Synonyms
371127-87-6
(Z)ethyl5(4fluorophenyl)7methyl2((5(4methylpiperazin1yl)furan2yl)methylene)3oxo35dihydro2Hthiazolo(32a)pyrimidine6carboxylate
371127876
CCOC(=O)C1=C(C)N=c2n(C1c1ccc(cc1)F)c(=O)c(=Cc1ccc(o1)N1CCN(CC1)C)s2
CCOC(=O)C1=C(N=C2N(C1C3=CC=C(C=C3)F)C(=O)C(=CC4=CC=C(O4)N5CCN(CC5)C)S2)C
ethyl(2Z)5(4fluorophenyl)7methyl2((5(4methylpiperazin1yl)furan2yl)methylidene)3oxo23dihydro5H(13)thiazolo(32a)pyrimidine6carboxylate
ETHYL(2Z)5(4FLUOROPHENYL)7METHYL2((5(4METHYLPIPERAZIN1YL)FURAN2YL)METHYLIDENE)3OXO5H(13)THIAZOLO(32A)PYRIMIDINE6CARBOXYLATE
InChI=1SC26H27FN4O4Sc143425(33)2216(2)282631(23(22)175718(27)8617)24(32)20(3626)151991021(3519)30131129(3)121430h5101523H41114H213H3b2015
MFCD02632146
ZINC000000685360
ZINC000000685362

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Available files

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