Vitas-M small molecule compound

2-(3,5-dimethylpiperidin-1-yl)-3-[(Z)-(3-heptyl-4-oxo-2-thioxo-1,3-thiazolidin-5-ylidene)methyl]-4H-pyrido[1,2-a]pyrimidin-4-one

Catalog ID
STK587215
SMILES CCCCCCCN1C(=S)S/C(=C\c2c(nc3n(c2=O)cccc3)N2CC(C)CC(C2)C)/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 C26H34N4O2S2 MW 498.71 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H34N4O2S2/c1-4-5-6-7-9-13-30-25(32)21(34-26(30)33)15-20-23(28-16-18(2)14-19(3)17-28)27-22-11-8-10-12-29(22)24(20)31/h8,10-12,15,18-19H,4-7,9,13-14,16-17H2,1-3H3/b21-15-
InChIKey
WARGEKXGCNEWHN-QNGOZBTKSA-N
Synonyms
879931-32-5
(5Z)5((2(35DIMETHYLPIPERIDIN1YL)4OXOPYRIDO(12A)PYRIMIDIN3YL)METHYLIDENE)3HEPTYL2SULFANYLIDENE13THIAZOLIDIN4ONE
(Z)5((2(35dimethylpiperidin1yl)4oxo4Hpyrido(12a)pyrimidin3yl)methylene)3heptyl2thioxothiazolidin4one
2(35dimethylpiperidin1yl)3((Z)(3heptyl4oxo2thioxo13thiazolidin5ylidene)methyl)4Hpyrido(12a)pyrimidin4one
879931325
CCCCCCCN1C(=O)C(=CC2=C(N=C3C=CC=CN3C2=O)N4CC(CC(C4)C)C)SC1=S
CCCCCCCN1C(=S)SC(=Cc2c(nc3n(c2=O)cccc3)N2CC(C)CC(C2)C)C1=O
InChI=1SC26H34N4O2S2c145679133025(32)21(3426(30)33)152023(281618(2)1419(3)1728)2722118101229(22)24(20)31h81012151819H47913141617H213H3b2115
MFCD06600381
ZINC000100958151
ZINC000100958156

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Available files

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