Vitas-M small molecule compound
3-[(5Z)-5-({2-[4-(4-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]propanoic acid
Catalog ID
STK903746
SMILES OC(=O)CCN1C(=S)S/C(=C\c2c(nc3n(c2=O)cc(cc3)C)N2CCN(CC2)c2ccc(cc2)F)/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 C26H24FN5O4S2 MW 553.64 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H24FN5O4S2/c1-16-2-7-21-28-23(30-12-10-29(11-13-30)18-5-3-17(27)4-6-18)19(24(35)32(21)15-16)14-20-25(36)31(26(37)38-20)9-8-22(33)34/h2-7,14-15H,8-13H2,1H3,(H,33,34)/b20-14-InChIKey
FWMKTKSBQNBCJO-ZHZULCJRSA-NSynonyms
(E)3(5((2(4(4fluorophenyl)piperazin1yl)7methyl4oxo4Hpyrido(12a)pyrimidin3yl)methylene)4oxo2thioxothiazolidin3yl)propanoicacid
3((5Z)5((2(4(4fluorophenyl)piperazin1yl)7methyl4oxo4Hpyrido(12a)pyrimidin3yl)methylidene)4oxo2thioxo13thiazolidin3yl)propanoicacid
3((5Z)5((2(4(4FLUOROPHENYL)PIPERAZIN1YL)7METHYL4OXOPYRIDO(12A)PYRIMIDIN3YL)METHYLIDENE)4OXO2SULFANYLIDENE13THIAZOLIDIN3YL)PROPANOICACID
CC1=CN2C(=NC(=C(C2=O)C=C3C(=O)N(C(=S)S3)CCC(=O)O)N4CCN(CC4)C5=CC=C(C=C5)F)C=C1
InChI=1SC26H24FN5O4S2c11627212823(30121029(111330)185317(27)4618)19(24(35)32(21)1516)142025(36)31(26(37)3820)9822(33)34h271415H813H21H3(H3334)b2014
MFCD18075952
OC(=O)CCN1C(=S)SC(=Cc2c(nc3n(c2=O)cc(cc3)C)N2CCN(CC2)c2ccc(cc2)F)C1=O
ZINC000097947286
ZINC97947286
Check stock
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Check stock on Vitas-MAvailable files
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