Vitas-M small molecule compound
2-[(2-hydroxy-2-phenylethyl)amino]-3-[(Z)-(3-methyl-4-oxo-2-thioxo-1,3-thiazolidin-5-ylidene)methyl]-4H-pyrido[1,2-a]pyrimidin-4-one
Catalog ID
STK707098
SMILES S=C1S/C(=C\c2c(NCC(c3ccccc3)O)nc3n(c2=O)cccc3)/C(=O)N1C
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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 C21H18N4O3S2 MW 438.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H18N4O3S2/c1-24-20(28)16(30-21(24)29)11-14-18(22-12-15(26)13-7-3-2-4-8-13)23-17-9-5-6-10-25(17)19(14)27/h2-11,15,22,26H,12H2,1H3/b16-11-InChIKey
KWWUWGDQVIFIGP-WJDWOHSUSA-NSynonyms
587013-32-9(5Z)5((2((2HYDROXY2PHENYLETHYL)AMINO)4OXOPYRIDO(12A)PYRIMIDIN3YL)METHYLIDENE)3METHYL2SULFANYLIDENE13THIAZOLIDIN4ONE
(Z)5((2((2hydroxy2phenylethyl)amino)4oxo4Hpyrido(12a)pyrimidin3yl)methylene)3methyl2thioxothiazolidin4one
2((2hydroxy2phenylethyl)amino)3((Z)(3methyl4oxo2thioxo13thiazolidin5ylidene)methyl)4Hpyrido(12a)pyrimidin4one
5((2((2HYDROXY2PHENYLETHYL)AMINO)4OXO(5HYDROPYRIDINO(12A)PYRIMIDIN3YL))METHYLENE)3METHYL2THIOXO13THIAZOLIDIN4ONE
587013329
CN1C(=O)C(=CC2=C(N=C3C=CC=CN3C2=O)NCC(C4=CC=CC=C4)O)SC1=S
InChI=1SC21H18N4O3S2c12420(28)16(3021(24)29)111418(221215(26)137324813)23179561025(17)19(14)27h211152226H12H21H3b1611
MFCD04034306
S=C1SC(=Cc2c(NCC(c3ccccc3)O)nc3n(c2=O)cccc3)C(=O)N1C
ZINC000002399300
ZINC000002399302
Check stock
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Check stock on Vitas-MAvailable files
Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.