Vitas-M small molecule compound
3-[(Z)-(3-hexyl-4-oxo-2-thioxo-1,3-thiazolidin-5-ylidene)methyl]-2-[(2-hydroxy-2-phenylethyl)amino]-4H-pyrido[1,2-a]pyrimidin-4-one
Catalog ID
STK707103
SMILES CCCCCCN1C(=S)S/C(=C\c2c(NCC(c3ccccc3)O)nc3n(c2=O)cccc3)/C1=O
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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 C26H28N4O3S2 MW 508.67 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H28N4O3S2/c1-2-3-4-9-15-30-25(33)21(35-26(30)34)16-19-23(27-17-20(31)18-11-6-5-7-12-18)28-22-13-8-10-14-29(22)24(19)32/h5-8,10-14,16,20,27,31H,2-4,9,15,17H2,1H3/b21-16-InChIKey
LGFJBWKXRSDFGU-PGMHBOJBSA-NSynonyms
843622-61-7(5Z)3HEXYL5((2((2HYDROXY2PHENYLETHYL)AMINO)4OXOPYRIDO(12A)PYRIMIDIN3YL)METHYLIDENE)2SULFANYLIDENE13THIAZOLIDIN4ONE
(Z)3hexyl5((2((2hydroxy2phenylethyl)amino)4oxo4Hpyrido(12a)pyrimidin3yl)methylene)2thioxothiazolidin4one
3((Z)(3hexyl4oxo2thioxo13thiazolidin5ylidene)methyl)2((2hydroxy2phenylethyl)amino)4Hpyrido(12a)pyrimidin4one
843622617
CCCCCCN1C(=O)C(=CC2=C(N=C3C=CC=CN3C2=O)NCC(C4=CC=CC=C4)O)SC1=S
CCCCCCN1C(=S)SC(=Cc2c(NCC(c3ccccc3)O)nc3n(c2=O)cccc3)C1=O
InChI=1SC26H28N4O3S2c12349153025(33)21(3526(30)34)161923(271720(31)18116571218)2822138101429(22)24(19)32h58101416202731H2491517H21H3b2116
MFCD04016571
ZINC000009459371
ZINC000009459373
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