Vitas-M small molecule compound

[(5Z)-5-({2-[4-(2-fluorophenyl)piperazin-1-yl]-7-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
STK707300
SMILES OC(=O)CN1C(=S)S/C(=C\c2c(nc3n(c2=O)cc(cc3)C)N2CCN(CC2)c2ccccc2F)/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 C25H22FN5O4S2 MW 539.61 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H22FN5O4S2/c1-15-6-7-20-27-22(29-10-8-28(9-11-29)18-5-3-2-4-17(18)26)16(23(34)30(20)13-15)12-19-24(35)31(14-21(32)33)25(36)37-19/h2-7,12-13H,8-11,14H2,1H3,(H,32,33)/b19-12-
InChIKey
IFWOPVZEEQDNDV-UNOMPAQXSA-N
Synonyms

((5Z)5((2(4(2fluorophenyl)piperazin1yl)7methyl4oxo4Hpyrido(12a)pyrimidin3yl)methylidene)4oxo2thioxo13thiazolidin3yl)aceticacid
(E)2(5((2(4(2fluorophenyl)piperazin1yl)7methyl4oxo4Hpyrido(12a)pyrimidin3yl)methylene)4oxo2thioxothiazolidin3yl)aceticacid
2((5Z)5((2(4(2FLUOROPHENYL)PIPERAZIN1YL)7METHYL4OXOPYRIDO(12A)PYRIMIDIN3YL)METHYLIDENE)4OXO2SULFANYLIDENE13THIAZOLIDIN3YL)ACETICACID
CC1=CN2C(=NC(=C(C2=O)C=C3C(=O)N(C(=S)S3)CC(=O)O)N4CCN(CC4)C5=CC=CC=C5F)C=C1
InChI=1SC25H22FN5O4S2c11567202722(2910828(91129)18532417(18)26)16(23(34)30(20)1315)121924(35)31(1421(32)33)25(36)3719h271213H81114H21H3(H3233)b1912
MFCD13371192
OC(=O)CN1C(=S)SC(=Cc2c(nc3n(c2=O)cc(cc3)C)N2CCN(CC2)c2ccccc2F)C1=O
ZINC000097947301
ZINC97947301

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Available files

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