Vitas-M small molecule compound
3-[(Z)-(3-heptyl-4-oxo-2-thioxo-1,3-thiazolidin-5-ylidene)methyl]-2-(pyrrolidin-1-yl)-4H-pyrido[1,2-a]pyrimidin-4-one
Catalog ID
STK820021
SMILES CCCCCCCN1C(=S)S/C(=C\c2c(nc3n(c2=O)cccc3)N2CCCC2)/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 C23H28N4O2S2 MW 456.63 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H28N4O2S2/c1-2-3-4-5-7-15-27-22(29)18(31-23(27)30)16-17-20(25-12-9-10-13-25)24-19-11-6-8-14-26(19)21(17)28/h6,8,11,14,16H,2-5,7,9-10,12-13,15H2,1H3/b18-16-InChIKey
BUENXWTYRBUBIS-VLGSPTGOSA-NSynonyms
(5Z)3HEPTYL5((4OXO2PYRROLIDIN1YLPYRIDO(12A)PYRIMIDIN3YL)METHYLIDENE)2SULFANYLIDENE13THIAZOLIDIN4ONE
3((Z)(3heptyl4oxo2thioxo13thiazolidin5ylidene)methyl)2(pyrrolidin1yl)4Hpyrido(12a)pyrimidin4one
CCCCCCCN1C(=O)C(=CC2=C(N=C3C=CC=CN3C2=O)N4CCCC4)SC1=S
CCCCCCCN1C(=S)SC(=Cc2c(nc3n(c2=O)cccc3)N2CCCC2)C1=O
InChI=1SC23H28N4O2S2c123457152722(29)18(3123(27)30)161720(25129101325)241911681426(19)21(17)28h68111416H257910121315H21H3b1816
MFCD04448711
ZINC000095927324
ZINC95927324
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