Vitas-M small molecule compound
2-[4-(3-chlorophenyl)piperazin-1-yl]-3-{(Z)-[4-oxo-3-(prop-2-en-1-yl)-2-thioxo-1,3-thiazolidin-5-ylidene]methyl}-4H-pyrido[1,2-a]pyrimidin-4-one
Catalog ID
STK799280
SMILES C=CCN1C(=S)S/C(=C\c2c(nc3n(c2=O)cccc3)N2CCN(CC2)c2cccc(c2)Cl)/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 C25H22ClN5O2S2 MW 524.07 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H22ClN5O2S2/c1-2-9-31-24(33)20(35-25(31)34)16-19-22(27-21-8-3-4-10-30(21)23(19)32)29-13-11-28(12-14-29)18-7-5-6-17(26)15-18/h2-8,10,15-16H,1,9,11-14H2/b20-16-InChIKey
QBTDAOAUVVAGAX-SILNSSARSA-NSynonyms
(5Z)5((2(4(3CHLOROPHENYL)PIPERAZIN1YL)4OXOPYRIDO(12A)PYRIMIDIN3YL)METHYLIDENE)3PROP2ENYL2SULFANYLIDENE13THIAZOLIDIN4ONE
2(4(3chlorophenyl)piperazin1yl)3((Z)(4oxo3(prop2en1yl)2thioxo13thiazolidin5ylidene)methyl)4Hpyrido(12a)pyrimidin4one
C=CCN1C(=O)C(=CC2=C(N=C3C=CC=CN3C2=O)N4CCN(CC4)C5=CC(=CC=C5)Cl)SC1=S
C=CCN1C(=S)SC(=Cc2c(nc3n(c2=O)cccc3)N2CCN(CC2)c2cccc(c2)Cl)C1=O
InChI=1SC25H22ClN5O2S2c1293124(33)20(3525(31)34)161922(27218341030(21)23(19)32)29131128(121429)1875617(26)1518h28101516H191114H2b2016
MFCD03462351
ZINC000001476913
ZINC1476913
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