Vitas-M small molecule compound
3-{(Z)-[3-(1,1-dioxidotetrahydrothiophen-3-yl)-4-oxo-2-thioxo-1,3-thiazolidin-5-ylidene]methyl}-2-(2-ethylpiperidin-1-yl)-9-methyl-4H-pyrido[1,2-a]pyrimidin-4-one
Catalog ID
STK881625
SMILES CCC1CCCCN1c1nc2c(C)cccn2c(=O)c1/C=C/1\SC(=S)N(C1=O)C1CCS(=O)(=O)C1
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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 C24H28N4O4S3 MW 532.71 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H28N4O4S3/c1-3-16-8-4-5-10-26(16)21-18(22(29)27-11-6-7-15(2)20(27)25-21)13-19-23(30)28(24(33)34-19)17-9-12-35(31,32)14-17/h6-7,11,13,16-17H,3-5,8-10,12,14H2,1-2H3/b19-13-InChIKey
RVOHPGJKAIYRBA-UYRXBGFRSA-NSynonyms
(5Z)3(11DIOXOTHIOLAN3YL)5((2(2ETHYLPIPERIDIN1YL)9METHYL4OXOPYRIDO(12A)PYRIMIDIN3YL)METHYLIDENE)2SULFANYLIDENE13THIAZOLIDIN4ONE
3((Z)(3(11dioxidotetrahydrothiophen3yl)4oxo2thioxo13thiazolidin5ylidene)methyl)2(2ethylpiperidin1yl)9methyl4Hpyrido(12a)pyrimidin4one
CCC1CCCCN1c1nc2c(C)cccn2c(=O)c1C=C1SC(=S)N(C1=O)C1CCS(=O)(=O)C1
CCC1CCCCN1C2=C(C(=O)N3C=CC=C(C3=N2)C)C=C4C(=O)N(C(=S)S4)C5CCS(=O)(=O)C5
InChI=1SC24H28N4O4S3c13168451026(16)2118(22(29)27116715(2)20(27)2521)131923(30)28(24(33)3419)1791235(3132)1417h6711131617H358101214H212H3b1913
MFCD18075925
ZINC000097947277
ZINC000253390524
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