Vitas-M small molecule compound
2-[(furan-2-ylmethyl)amino]-3-[(Z)-(3-heptyl-4-oxo-2-thioxo-1,3-thiazolidin-5-ylidene)methyl]-9-methyl-4H-pyrido[1,2-a]pyrimidin-4-one
Catalog ID
STK705602
SMILES CCCCCCCN1C(=S)S/C(=C\c2c(NCc3ccco3)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 C25H28N4O3S2 MW 496.65 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H28N4O3S2/c1-3-4-5-6-7-12-29-24(31)20(34-25(29)33)15-19-21(26-16-18-11-9-14-32-18)27-22-17(2)10-8-13-28(22)23(19)30/h8-11,13-15,26H,3-7,12,16H2,1-2H3/b20-15-InChIKey
XGQWBIZUEUGWQR-HKWRFOASSA-NSynonyms
(5Z)5((2(FURAN2YLMETHYLAMINO)9METHYL4OXOPYRIDO(12A)PYRIMIDIN3YL)METHYLIDENE)3HEPTYL2SULFANYLIDENE13THIAZOLIDIN4ONE
2((furan2ylmethyl)amino)3((Z)(3heptyl4oxo2thioxo13thiazolidin5ylidene)methyl)9methyl4Hpyrido(12a)pyrimidin4one
CCCCCCCN1C(=O)C(=CC2=C(N=C3C(=CC=CN3C2=O)C)NCC4=CC=CO4)SC1=S
CCCCCCCN1C(=S)SC(=Cc2c(NCc3ccco3)nc3n(c2=O)cccc3C)C1=O
InChI=1SC25H28N4O3S2c134567122924(31)20(3425(29)33)151921(261618119143218)272217(2)1081328(22)23(19)30h811131526H371216H212H3b2015
MFCD04446785
ZINC000097946679
ZINC97946679
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