Vitas-M small molecule compound
2-[(4-methylbenzyl)amino]-3-[(Z)-(4-oxo-3-pentyl-2-thioxo-1,3-thiazolidin-5-ylidene)methyl]-4H-pyrido[1,2-a]pyrimidin-4-one
Catalog ID
STK815504
SMILES CCCCCN1C(=S)S/C(=C\c2c(NCc3ccc(cc3)C)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 C25H26N4O2S2 MW 478.64 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H26N4O2S2/c1-3-4-6-14-29-24(31)20(33-25(29)32)15-19-22(26-16-18-11-9-17(2)10-12-18)27-21-8-5-7-13-28(21)23(19)30/h5,7-13,15,26H,3-4,6,14,16H2,1-2H3/b20-15-InChIKey
KKFDWTMQFAUMCV-HKWRFOASSA-NSynonyms
(5Z)5((2((4METHYLPHENYL)METHYLAMINO)4OXOPYRIDO(12A)PYRIMIDIN3YL)METHYLIDENE)3PENTYL2SULFANYLIDENE13THIAZOLIDIN4ONE
2((4methylbenzyl)amino)3((Z)(4oxo3pentyl2thioxo13thiazolidin5ylidene)methyl)4Hpyrido(12a)pyrimidin4one
CCCCCN1C(=O)C(=CC2=C(N=C3C=CC=CN3C2=O)NCC4=CC=C(C=C4)C)SC1=S
CCCCCN1C(=S)SC(=Cc2c(NCc3ccc(cc3)C)nc3n(c2=O)cccc3)C1=O
InChI=1SC25H26N4O2S2c1346142924(31)20(3325(29)32)151922(26161811917(2)101218)27218571328(21)23(19)30h57131526H3461416H212H3b2015
MFCD03212675
ZINC000016732616
ZINC16732616
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