Vitas-M small molecule compound

9-methyl-3-[(Z)-(3-methyl-4-oxo-2-thioxo-1,3-thiazolidin-5-ylidene)methyl]-2-[(2-phenylethyl)amino]-4H-pyrido[1,2-a]pyrimidin-4-one

Catalog ID
STK876829
SMILES CN1C(=S)S/C(=C\c2c(NCCc3ccccc3)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 C22H20N4O2S2 MW 436.56 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H20N4O2S2/c1-14-7-6-12-26-19(14)24-18(23-11-10-15-8-4-3-5-9-15)16(20(26)27)13-17-21(28)25(2)22(29)30-17/h3-9,12-13,23H,10-11H2,1-2H3/b17-13-
InChIKey
POPKNGWUCMHMKK-LGMDPLHJSA-N
Synonyms
329923-48-0
(5Z)3methyl5((9methyl4oxo2(2phenylethylamino)pyrido(12a)pyrimidin3yl)methylidene)2sulfanylidene13thiazolidin4one
(5Z)3METHYL5((9METHYL4OXO2(PHENETHYLAMINO)PYRIDO(12A)PYRIMIDIN3YL)METHYLIDENE)2SULFANYLIDENE13THIAZOLIDIN4ONE
(Z)3methyl5((9methyl4oxo2(phenethylamino)4Hpyrido(12a)pyrimidin3yl)methylene)2thioxothiazolidin4one
329923480
9methyl3((Z)(3methyl4oxo2thioxo13thiazolidin5ylidene)methyl)2((2phenylethyl)amino)4Hpyrido(12a)pyrimidin4one
CC1=CC=CN2C1=NC(=C(C2=O)C=C3C(=O)N(C(=S)S3)C)NCCC4=CC=CC=C4
CN1C(=S)SC(=Cc2c(NCCc3ccccc3)nc3n(c2=O)cccc3C)C1=O
InChI=1SC22H20N4O2S2c11476122619(14)2418(231110158435915)16(20(26)27)131721(28)25(2)22(29)3017h39121323H1011H212H3b1713
MFCD03285857
ZINC000001251487
ZINC1251487

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Available files

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