Vitas-M small molecule compound
3-{(Z)-[4-oxo-3-(prop-2-en-1-yl)-2-thioxo-1,3-thiazolidin-5-ylidene]methyl}-2-(pyrrolidin-1-yl)-4H-pyrido[1,2-a]pyrimidin-4-one
Catalog ID
STK819596
SMILES C=CCN1C(=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 C19H18N4O2S2 MW 398.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H18N4O2S2/c1-2-8-23-18(25)14(27-19(23)26)12-13-16(21-9-5-6-10-21)20-15-7-3-4-11-22(15)17(13)24/h2-4,7,11-12H,1,5-6,8-10H2/b14-12-InChIKey
ATGRBDLSTSMATH-OWBHPGMISA-NSynonyms
(5Z)5((4OXO2PYRROLIDIN1YLPYRIDO(12A)PYRIMIDIN3YL)METHYLIDENE)3PROP2ENYL2SULFANYLIDENE13THIAZOLIDIN4ONE
3((Z)(4oxo3(prop2en1yl)2thioxo13thiazolidin5ylidene)methyl)2(pyrrolidin1yl)4Hpyrido(12a)pyrimidin4one
C=CCN1C(=O)C(=CC2=C(N=C3C=CC=CN3C2=O)N4CCCC4)SC1=S
C=CCN1C(=S)SC(=Cc2c(nc3n(c2=O)cccc3)N2CCCC2)C1=O
InChI=1SC19H18N4O2S2c1282318(25)14(2719(23)26)121316(219561021)20157341122(15)17(13)24h2471112H156810H2b1412
MFCD04448505
ZINC000006293427
ZINC6293427
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