Vitas-M small molecule compound

2-(methylamino)-3-{(Z)-[4-oxo-3-(3-phenylpropyl)-2-thioxo-1,3-thiazolidin-5-ylidene]methyl}-4H-pyrido[1,2-a]pyrimidin-4-one

Catalog ID
STK586902
SMILES CNc1nc2ccccn2c(=O)c1/C=C/1\SC(=S)N(C1=O)CCCc1ccccc1

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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 C22H20N4O2S2 MW 436.56 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H20N4O2S2/c1-23-19-16(20(27)25-12-6-5-11-18(25)24-19)14-17-21(28)26(22(29)30-17)13-7-10-15-8-3-2-4-9-15/h2-6,8-9,11-12,14,23H,7,10,13H2,1H3/b17-14-
InChIKey
COAMRZQLJGPIRT-VKAVYKQESA-N
Synonyms
853753-64-7
(5Z)5((2(METHYLAMINO)4OXOPYRIDO(12A)PYRIMIDIN3YL)METHYLIDENE)3(3PHENYLPROPYL)2SULFANYLIDENE13THIAZOLIDIN4ONE
(Z)5((2(methylamino)4oxo4Hpyrido(12a)pyrimidin3yl)methylene)3(3phenylpropyl)2thioxothiazolidin4one
2(methylamino)3((Z)(4oxo3(3phenylpropyl)2thioxo13thiazolidin5ylidene)methyl)4Hpyrido(12a)pyrimidin4one
5((2(METHYLAMINO)4OXO(5HYDROPYRIDINO(12A)PYRIMIDIN3YL))METHYLENE)3(3PHENYLPROPYL)2THIOXO13THIAZOLIDIN4ONE
853753647
CNC1=C(C(=O)N2C=CC=CC2=N1)C=C3C(=O)N(C(=S)S3)CCCC4=CC=CC=C4
CNc1nc2ccccn2c(=O)c1C=C1SC(=S)N(C1=O)CCCc1ccccc1
InChI=1SC22H20N4O2S2c1231916(20(27)2512651118(25)2419)141721(28)26(22(29)3017)13710158324915h268911121423H71013H21H3b1714
MFCD03664972
ZINC000002219606
ZINC2219606

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.