Vitas-M small molecule compound

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

Catalog ID
STK877051
SMILES CC(N1C(=S)S/C(=C\c2c(nc3n(c2=O)cccc3C)N2CCCC2)/C1=O)C

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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 C20H22N4O2S2 MW 414.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H22N4O2S2/c1-12(2)24-19(26)15(28-20(24)27)11-14-17(22-8-4-5-9-22)21-16-13(3)7-6-10-23(16)18(14)25/h6-7,10-12H,4-5,8-9H2,1-3H3/b15-11-
InChIKey
RWAPEPDIECPOAZ-PTNGSMBKSA-N
Synonyms
361995-06-4
(5Z)5((9METHYL4OXO2PYRROLIDIN1YLPYRIDO(12A)PYRIMIDIN3YL)METHYLIDENE)3PROPAN2YL2SULFANYLIDENE13THIAZOLIDIN4ONE
(Z)3isopropyl5((9methyl4oxo2(pyrrolidin1yl)4Hpyrido(12a)pyrimidin3yl)methylene)2thioxothiazolidin4one
3(METHYLETHYL)5((9METHYL4OXO2PYRROLIDINYL(5HYDROPYRIDINO(12A)PYRIMIDIN3YL))METHYLENE)2THIOXO13THIAZOLIDIN4ONE
361995064
9methyl3((Z)(4oxo3(propan2yl)2thioxo13thiazolidin5ylidene)methyl)2(pyrrolidin1yl)4Hpyrido(12a)pyrimidin4one
CC(N1C(=S)SC(=Cc2c(nc3n(c2=O)cccc3C)N2CCCC2)C1=O)C
CC1=CC=CN2C1=NC(=C(C2=O)C=C3C(=O)N(C(=S)S3)C(C)C)N4CCCC4
InChI=1SC20H22N4O2S2c112(2)2419(26)15(2820(24)27)111417(22845922)211613(3)761023(16)18(14)25h671012H4589H213H3b1511
MFCD01955284
ZINC000001084362
ZINC1084362

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Available files

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