Vitas-M small molecule compound

2-(2,6-dimethylmorpholin-4-yl)-3-{(Z)-[3-(3-methoxypropyl)-4-oxo-2-thioxo-1,3-thiazolidin-5-ylidene]methyl}-9-methyl-4H-pyrido[1,2-a]pyrimidin-4-one

Catalog ID
STK877026
SMILES COCCCN1C(=S)S/C(=C\c2c(nc3n(c2=O)cccc3C)N2CC(C)OC(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 C23H28N4O4S2 MW 488.63 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H28N4O4S2/c1-14-7-5-8-26-19(14)24-20(25-12-15(2)31-16(3)13-25)17(21(26)28)11-18-22(29)27(23(32)33-18)9-6-10-30-4/h5,7-8,11,15-16H,6,9-10,12-13H2,1-4H3/b18-11-
InChIKey
OFYYIWLNOYWOBK-WQRHYEAKSA-N
Synonyms
372976-76-6
(5Z)5((2(26DIMETHYLMORPHOLIN4YL)9METHYL4OXOPYRIDO(12A)PYRIMIDIN3YL)METHYLIDENE)3(3METHOXYPROPYL)2SULFANYLIDENE13THIAZOLIDIN4ONE
(Z)5((2(26dimethylmorpholino)9methyl4oxo4Hpyrido(12a)pyrimidin3yl)methylene)3(3methoxypropyl)2thioxothiazolidin4one
2(26dimethylmorpholin4yl)3((Z)(3(3methoxypropyl)4oxo2thioxo13thiazolidin5ylidene)methyl)9methyl4Hpyrido(12a)pyrimidin4one
372976766
CC1CN(CC(O1)C)C2=C(C(=O)N3C=CC=C(C3=N2)C)C=C4C(=O)N(C(=S)S4)CCCOC
COCCCN1C(=S)SC(=Cc2c(nc3n(c2=O)cccc3C)N2CC(C)OC(C2)C)C1=O
InChI=1SC23H28N4O4S2c1147582619(14)2420(251215(2)3116(3)1325)17(21(26)28)111822(29)27(23(32)3318)9610304h578111516H69101213H214H3b1811
MFCD01953918
ZINC000002388403
ZINC000013424034

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Available files

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