Vitas-M small molecule compound

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

Catalog ID
STK877024
SMILES C=CCNc1nc2c(C)cccn2c(=O)c1/C=C/1\SC(=S)N(C1=O)C(c1ccccc1)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 C24H22N4O2S2 MW 462.60 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H22N4O2S2/c1-4-12-25-20-18(22(29)27-13-8-9-15(2)21(27)26-20)14-19-23(30)28(24(31)32-19)16(3)17-10-6-5-7-11-17/h4-11,13-14,16,25H,1,12H2,2-3H3/b19-14-
InChIKey
BNOWUPJMKHRLTB-RGEXLXHISA-N
Synonyms
361995-71-3
(5Z)5((9METHYL4OXO2(PROP2ENYLAMINO)PYRIDO(12A)PYRIMIDIN3YL)METHYLIDENE)3(1PHENYLETHYL)2SULFANYLIDENE13THIAZOLIDIN4ONE
(Z)5((2(allylamino)9methyl4oxo4Hpyrido(12a)pyrimidin3yl)methylene)3(1phenylethyl)2thioxothiazolidin4one
361995713
9methyl3((Z)(4oxo3(1phenylethyl)2thioxo13thiazolidin5ylidene)methyl)2(prop2en1ylamino)4Hpyrido(12a)pyrimidin4one
C=CCNc1nc2c(C)cccn2c(=O)c1C=C1SC(=S)N(C1=O)C(c1ccccc1)C
CC1=CC=CN2C1=NC(=C(C2=O)C=C3C(=O)N(C(=S)S3)C(C)C4=CC=CC=C4)NCC=C
InChI=1SC24H22N4O2S2c1412252018(22(29)27138915(2)21(27)2620)141923(30)28(24(31)3219)16(3)17106571117h41113141625H112H223H3b1914
MFCD01947069
ZINC000002280593
ZINC000002280594

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Available files

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