Vitas-M small molecule compound
3-{(Z)-[3-(1,1-dioxidotetrahydrothiophen-3-yl)-4-oxo-2-thioxo-1,3-thiazolidin-5-ylidene]methyl}-7-methyl-2-[(2-methylpropyl)amino]-4H-pyrido[1,2-a]pyrimidin-4-one
Catalog ID
STK903740
SMILES CC(CNc1nc2ccc(cn2c(=O)c1/C=C/1\SC(=S)N(C1=O)C1CCS(=O)(=O)C1)C)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 C21H24N4O4S3 MW 492.64 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H24N4O4S3/c1-12(2)9-22-18-15(19(26)24-10-13(3)4-5-17(24)23-18)8-16-20(27)25(21(30)31-16)14-6-7-32(28,29)11-14/h4-5,8,10,12,14,22H,6-7,9,11H2,1-3H3/b16-8-InChIKey
VYVGJTCTSZCQKK-PXNMLYILSA-NSynonyms
608497-74-1(5Z)3(11DIOXOTHIOLAN3YL)5((7METHYL2(2METHYLPROPYLAMINO)4OXOPYRIDO(12A)PYRIMIDIN3YL)METHYLIDENE)2SULFANYLIDENE13THIAZOLIDIN4ONE
(Z)3(11dioxidotetrahydrothiophen3yl)5((2(isobutylamino)7methyl4oxo4Hpyrido(12a)pyrimidin3yl)methylene)2thioxothiazolidin4one
3((Z)(3(11dioxidotetrahydrothiophen3yl)4oxo2thioxo13thiazolidin5ylidene)methyl)7methyl2((2methylpropyl)amino)4Hpyrido(12a)pyrimidin4one
608497741
CC(CNc1nc2ccc(cn2c(=O)c1C=C1SC(=S)N(C1=O)C1CCS(=O)(=O)C1)C)C
CC1=CN2C(=NC(=C(C2=O)C=C3C(=O)N(C(=S)S3)C4CCS(=O)(=O)C4)NCC(C)C)C=C1
InChI=1SC21H24N4O4S3c112(2)9221815(19(26)241013(3)4517(24)2318)81620(27)25(21(30)3116)146732(2829)1114h45810121422H67911H213H3b168
MFCD03691799
ZINC000009003810
ZINC000013714022
Check stock
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Check stock on Vitas-MAvailable files
Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.