Vitas-M small molecule compound
3-[(5Z)-5-{[2-(2-chlorophenoxy)-4-oxo-4H-pyrido[1,2-a]pyrimidin-3-yl]methylidene}-4-oxo-2-thioxo-1,3-thiazolidin-3-yl]propanoic acid
Catalog ID
STK583397
SMILES OC(=O)CCN1C(=S)S/C(=C\c2c(Oc3ccccc3Cl)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 C21H14ClN3O5S2 MW 487.94 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H14ClN3O5S2/c22-13-5-1-2-6-14(13)30-18-12(19(28)24-9-4-3-7-16(24)23-18)11-15-20(29)25(21(31)32-15)10-8-17(26)27/h1-7,9,11H,8,10H2,(H,26,27)/b15-11-InChIKey
JYKBYUOIGFNNKM-PTNGSMBKSA-NSynonyms
847379-81-1(Z)3(5((2(2chlorophenoxy)4oxo4Hpyrido(12a)pyrimidin3yl)methylene)4oxo2thioxothiazolidin3yl)propanoicacid
3((5Z)5((2(2chlorophenoxy)4oxo4Hpyrido(12a)pyrimidin3yl)methylidene)4oxo2thioxo13thiazolidin3yl)propanoicacid
3((5Z)5((2(2CHLOROPHENOXY)4OXOPYRIDO(12A)PYRIMIDIN3YL)METHYLIDENE)4OXO2SULFANYLIDENE13THIAZOLIDIN3YL)PROPANOICACID
847379811
C1=CC=C(C(=C1)OC2=C(C(=O)N3C=CC=CC3=N2)C=C4C(=O)N(C(=S)S4)CCC(=O)O)Cl
InChI=1SC21H14ClN3O5S2c2213512614(13)301812(19(28)24943716(24)2318)111520(29)25(21(31)3215)10817(26)27h17911H810H2(H2627)b1511
MFCD04181700
OC(=O)CCN1C(=S)SC(=Cc2c(Oc3ccccc3Cl)nc3n(c2=O)cccc3)C1=O
ZINC000013556578
ZINC13556578
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