Vitas-M small molecule compound
[(5Z)-5-{[2-(4-fluorophenoxy)-9-methyl-4-oxo-4H-pyrido[1,2-a]pyrimidin-3-yl]methylidene}-4-oxo-2-thioxo-1,3-thiazolidin-3-yl]acetic acid
Catalog ID
STK906585
SMILES OC(=O)CN1C(=S)S/C(=C\c2c(Oc3ccc(cc3)F)nc3n(c2=O)cccc3C)/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 C21H14FN3O5S2 MW 471.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H14FN3O5S2/c1-11-3-2-8-24-17(11)23-18(30-13-6-4-12(22)5-7-13)14(19(24)28)9-15-20(29)25(10-16(26)27)21(31)32-15/h2-9H,10H2,1H3,(H,26,27)/b15-9-InChIKey
GCENNTNLTOIDLE-DHDCSXOGSA-NSynonyms
846065-14-3((5Z)5((2(4fluorophenoxy)9methyl4oxo4Hpyrido(12a)pyrimidin3yl)methylidene)4oxo2thioxo13thiazolidin3yl)aceticacid
(Z)2(5((2(4fluorophenoxy)9methyl4oxo4Hpyrido(12a)pyrimidin3yl)methylene)4oxo2thioxothiazolidin3yl)aceticacid
2((5Z)5((2(4FLUOROPHENOXY)9METHYL4OXOPYRIDO(12A)PYRIMIDIN3YL)METHYLIDENE)4OXO2SULFANYLIDENE13THIAZOLIDIN3YL)ACETICACID
CC1=CC=CN2C1=NC(=C(C2=O)C=C3C(=O)N(C(=S)S3)CC(=O)O)OC4=CC=C(C=C4)F
OC(=O)CN1C(=S)SC(=Cc2c(Oc3ccc(cc3)F)nc3n(c2=O)cccc3C)C1=O
Registry IDs
MFCD04174002ZINC000013770101
ZINC13770101
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