Vitas-M small molecule compound
5-{(Z)-[3-(2-methoxyethyl)-4-oxo-2-thioxo-1,3-thiazolidin-5-ylidene]methyl}-1,4-dimethyl-6-(4-methylpiperazin-1-yl)-2-oxo-1,2-dihydropyridine-3-carbonitrile
Catalog ID
STK576082
SMILES COCCN1C(=S)S/C(=C\c2c(N3CCN(CC3)C)n(C)c(=O)c(c2C)C#N)/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 C20H25N5O3S2 MW 447.58 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H25N5O3S2/c1-13-14(11-16-19(27)25(9-10-28-4)20(29)30-16)17(23(3)18(26)15(13)12-21)24-7-5-22(2)6-8-24/h11H,5-10H2,1-4H3/b16-11-InChIKey
DBJNDDXJXGGRMI-WJDWOHSUSA-NSynonyms
620149-32-8(Z)5((3(2methoxyethyl)4oxo2thioxothiazolidin5ylidene)methyl)14dimethyl6(4methylpiperazin1yl)2oxo12dihydropyridine3carbonitrile
5((Z)(3(2METHOXYETHYL)4OXO2SULFANYLIDENE13THIAZOLIDIN5YLIDENE)METHYL)14DIMETHYL6(4METHYLPIPERAZIN1YL)2OXOPYRIDINE3CARBONITRILE
5((Z)(3(2methoxyethyl)4oxo2thioxo13thiazolidin5ylidene)methyl)14dimethyl6(4methylpiperazin1yl)2oxo12dihydropyridine3carbonitrile
CC1=C(C(=O)N(C(=C1C=C2C(=O)N(C(=S)S2)CCOC)N3CCN(CC3)C)C)C#N
COCCN1C(=S)SC(=Cc2c(N3CCN(CC3)C)n(C)c(=O)c(c2C)C#N)C1=O
Registry IDs
MFCD03685300ZINC000002347215
ZINC2347215
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