Vitas-M small molecule compound

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

Catalog ID
STK876519
SMILES CCCNc1nc2c(C)cccn2c(=O)c1/C=C/1\SC(=S)N(C1=O)CC1CCCO1

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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 C21H24N4O3S2 MW 444.58 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H24N4O3S2/c1-3-8-22-17-15(19(26)24-9-4-6-13(2)18(24)23-17)11-16-20(27)25(21(29)30-16)12-14-7-5-10-28-14/h4,6,9,11,14,22H,3,5,7-8,10,12H2,1-2H3/b16-11-
InChIKey
NVUNNDVJXHPICL-WJDWOHSUSA-N
Synonyms

(5Z)5((9METHYL4OXO2(PROPYLAMINO)PYRIDO(12A)PYRIMIDIN3YL)METHYLIDENE)3(OXOLAN2YLMETHYL)2SULFANYLIDENE13THIAZOLIDIN4ONE
(Z)5((9methyl4oxo2(propylamino)4Hpyrido(12a)pyrimidin3yl)methylene)3((tetrahydrofuran2yl)methyl)2thioxothiazolidin4one
9METHYL3((4OXO3(TETRAHYDRO2FURANYLMETHYL)2THIOXO13THIAZOLIDIN5YLIDENE)METHYL)2(PROPYLAMINO)4HPYRIDO(12A)PYRIMIDIN4ONE
9methyl3((Z)(4oxo3(tetrahydrofuran2ylmethyl)2thioxo13thiazolidin5ylidene)methyl)2(propylamino)4Hpyrido(12a)pyrimidin4one
CCCNC1=C(C(=O)N2C=CC=C(C2=N1)C)C=C3C(=O)N(C(=S)S3)CC4CCCO4
InChI=1SC21H24N4O3S2c138221715(19(26)2494613(2)18(24)2317)111620(27)25(21(29)3016)121475102814h469111422H35781012H212H3b1611
MFCD02977714
ZINC000002303955
ZINC000002303957

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Available files

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