Vitas-M small molecule compound
4-{(5Z)-5-[(2-{[2-(2-hydroxyethoxy)ethyl]amino}-4-oxo-4H-pyrido[1,2-a]pyrimidin-3-yl)methylidene]-4-oxo-2-thioxo-1,3-thiazolidin-3-yl}butanoic acid
Catalog ID
STK811084
SMILES OCCOCCNc1nc2ccccn2c(=O)c1/C=C/1\SC(=S)N(C1=O)CCCC(=O)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 C20H22N4O6S2 MW 478.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H22N4O6S2/c25-9-11-30-10-6-21-17-13(18(28)23-7-2-1-4-15(23)22-17)12-14-19(29)24(20(31)32-14)8-3-5-16(26)27/h1-2,4,7,12,21,25H,3,5-6,8-11H2,(H,26,27)/b14-12-InChIKey
ZVQIAOUMRGSPEO-OWBHPGMISA-NSynonyms
4((5Z)5((2((2(2hydroxyethoxy)ethyl)amino)4oxo4Hpyrido(12a)pyrimidin3yl)methylidene)4oxo2thioxo13thiazolidin3yl)butanoicacid
4((5Z)5((2(2(2HYDROXYETHOXY)ETHYLAMINO)4OXOPYRIDO(12A)PYRIMIDIN3YL)METHYLIDENE)4OXO2SULFANYLIDENE13THIAZOLIDIN3YL)BUTANOICACID
C1=CC2=NC(=C(C(=O)N2C=C1)C=C3C(=O)N(C(=S)S3)CCCC(=O)O)NCCOCCO
InChI=1SC20H22N4O6S2c2591130106211713(18(28)23721415(23)2217)121419(29)24(20(31)3214)83516(26)27h1247122125H356811H2(H2627)b1412
MFCD03720080
OCCOCCNc1nc2ccccn2c(=O)c1C=C1SC(=S)N(C1=O)CCCC(=O)O
ZINC000016713542
ZINC16713542
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