Vitas-M small molecule compound
3-[(Z)-(3-heptyl-4-oxo-2-thioxo-1,3-thiazolidin-5-ylidene)methyl]-9-methyl-2-(propylamino)-4H-pyrido[1,2-a]pyrimidin-4-one
Catalog ID
STK799609
SMILES CCCCCCCN1C(=S)S/C(=C\c2c(NCCC)nc3n(c2=O)cccc3C)/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 C23H30N4O2S2 MW 458.65 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H30N4O2S2/c1-4-6-7-8-9-13-27-22(29)18(31-23(27)30)15-17-19(24-12-5-2)25-20-16(3)11-10-14-26(20)21(17)28/h10-11,14-15,24H,4-9,12-13H2,1-3H3/b18-15-InChIKey
QTRUBQJPUPKHHE-SDXDJHTJSA-NSynonyms
(5Z)3HEPTYL5((9METHYL4OXO2(PROPYLAMINO)PYRIDO(12A)PYRIMIDIN3YL)METHYLIDENE)2SULFANYLIDENE13THIAZOLIDIN4ONE
3((Z)(3heptyl4oxo2thioxo13thiazolidin5ylidene)methyl)9methyl2(propylamino)4Hpyrido(12a)pyrimidin4one
CCCCCCCN1C(=O)C(=CC2=C(N=C3C(=CC=CN3C2=O)C)NCCC)SC1=S
CCCCCCCN1C(=S)SC(=Cc2c(NCCC)nc3n(c2=O)cccc3C)C1=O
InChI=1SC23H30N4O2S2c146789132722(29)18(3123(27)30)151719(241252)252016(3)11101426(20)21(17)28h1011141524H491213H213H3b1815
MFCD04446952
ZINC000095927183
ZINC95927183
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