Vitas-M small molecule compound
[(5Z)-5-{[2-(3-methylphenoxy)-4-oxo-4H-pyrido[1,2-a]pyrimidin-3-yl]methylidene}-4-oxo-2-thioxo-1,3-thiazolidin-3-yl]acetic acid
Catalog ID
STK905808
SMILES OC(=O)CN1C(=S)S/C(=C\c2c(Oc3cccc(c3)C)nc3n(c2=O)cccc3)/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 C21H15N3O5S2 MW 453.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H15N3O5S2/c1-12-5-4-6-13(9-12)29-18-14(19(27)23-8-3-2-7-16(23)22-18)10-15-20(28)24(11-17(25)26)21(30)31-15/h2-10H,11H2,1H3,(H,25,26)/b15-10-InChIKey
HEANAZWSUBZIMN-GDNBJRDFSA-NSynonyms
846597-22-6((5Z)5((2(3methylphenoxy)4oxo4Hpyrido(12a)pyrimidin3yl)methylidene)4oxo2thioxo13thiazolidin3yl)aceticacid
(Z)2(4oxo5((4oxo2(mtolyloxy)4Hpyrido(12a)pyrimidin3yl)methylene)2thioxothiazolidin3yl)aceticacid
2((5Z)5((2(3METHYLPHENOXY)4OXOPYRIDO(12A)PYRIMIDIN3YL)METHYLIDENE)4OXO2SULFANYLIDENE13THIAZOLIDIN3YL)ACETICACID
846597226
CC1=CC(=CC=C1)OC2=C(C(=O)N3C=CC=CC3=N2)C=C4C(=O)N(C(=S)S4)CC(=O)O
InChI=1SC21H15N3O5S2c11254613(912)291814(19(27)23832716(23)2218)101520(28)24(1117(25)26)21(30)3115h210H11H21H3(H2526)b1510
MFCD04176691
OC(=O)CN1C(=S)SC(=Cc2c(Oc3cccc(c3)C)nc3n(c2=O)cccc3)C1=O
ZINC000013770844
ZINC13770844
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