Vitas-M small molecule compound
3-[(5Z)-5-({2-[4-(2-hydroxyethyl)piperazin-1-yl]-4-oxo-4H-pyrido[1,2-a]pyrimidin-3-yl}methylidene)-4-oxo-2-thioxo-1,3-thiazolidin-3-yl]propanoic acid
Catalog ID
STL200744
SMILES OCCN1CCN(CC1)c1nc2ccccn2c(=O)c1/C=C/1\SC(=S)N(C1=O)CCC(=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 C21H23N5O5S2 MW 489.58 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H23N5O5S2/c27-12-11-23-7-9-24(10-8-23)18-14(19(30)25-5-2-1-3-16(25)22-18)13-15-20(31)26(21(32)33-15)6-4-17(28)29/h1-3,5,13,27H,4,6-12H2,(H,28,29)/b15-13-InChIKey
RSMNZHZRTXTNLV-SQFISAMPSA-NSynonyms
3((5Z)5((2(4(2hydroxyethyl)piperazin1yl)4oxo4Hpyrido(12a)pyrimidin3yl)methylidene)4oxo2thioxo13thiazolidin3yl)propanoicacid
3((5Z)5((2(4(2HYDROXYETHYL)PIPERAZIN1YL)4OXOPYRIDO(12A)PYRIMIDIN3YL)METHYLIDENE)4OXO2SULFANYLIDENE13THIAZOLIDIN3YL)PROPANOICACID
C1CN(CCN1CCO)C2=C(C(=O)N3C=CC=CC3=N2)C=C4C(=O)N(C(=S)S4)CCC(=O)O
InChI=1SC21H23N5O5S2c271211237924(10823)1814(19(30)25521316(25)2218)131520(31)26(21(32)3315)6417(28)29h1351327H4612H2(H2829)b1513
MFCD03496081
OCCN1CCN(CC1)c1nc2ccccn2c(=O)c1C=C1SC(=S)N(C1=O)CCC(=O)O
ZINC000016732635
ZINC16732635
Check stock
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