Vitas-M small molecule compound
4-[(5Z)-5-({2-[(furan-2-ylmethyl)amino]-7-methyl-4-oxo-4H-pyrido[1,2-a]pyrimidin-3-yl}methylidene)-4-oxo-2-thioxo-1,3-thiazolidin-3-yl]butanoic acid
Catalog ID
STK813992
SMILES OC(=O)CCCN1C(=S)S/C(=C\c2c(NCc3ccco3)nc3n(c2=O)cc(cc3)C)/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 C22H20N4O5S2 MW 484.56 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H20N4O5S2/c1-13-6-7-17-24-19(23-11-14-4-3-9-31-14)15(20(29)26(17)12-13)10-16-21(30)25(22(32)33-16)8-2-5-18(27)28/h3-4,6-7,9-10,12,23H,2,5,8,11H2,1H3,(H,27,28)/b16-10-InChIKey
FTRRQJMEYJBFBT-YBEGLDIGSA-NSynonyms
505079-04-94((5Z)5((2((furan2ylmethyl)amino)7methyl4oxo4Hpyrido(12a)pyrimidin3yl)methylidene)4oxo2thioxo13thiazolidin3yl)butanoicacid
4((5Z)5((2(FURAN2YLMETHYLAMINO)7METHYL4OXOPYRIDO(12A)PYRIMIDIN3YL)METHYLIDENE)4OXO2SULFANYLIDENE13THIAZOLIDIN3YL)BUTANOICACID
4(5((2((2FURYLMETHYL)AMINO)7METHYL4OXO(5HYDROPYRIDINO(12A)PYRIMIDIN3YL))METHYLENE)4OXO2THIOXO13THIAZOLIDIN3YL)BUTANOICACID
4(5((2((FURAN2YLMETHYL)AMINO)7METHYL4OXO4HPYRIDO(12A)PYRIMIDIN3YL)METHYLENE)4OXO2THIOXOTHIAZOLIDIN3YL)BUTANOICACID
505079049
CC1=CN2C(=NC(=C(C2=O)C=C3C(=O)N(C(=S)S3)CCCC(=O)O)NCC4=CC=CO4)C=C1
InChI=1SC22H20N4O5S2c11367172419(2311144393114)15(20(29)26(17)1213)101621(30)25(22(32)3316)82518(27)28h34679101223H25811H21H3(H2728)b1610
MFCD03496115
OC(=O)CCCN1C(=S)SC(=Cc2c(NCc3ccco3)nc3n(c2=O)cc(cc3)C)C1=O
ZINC000002508689
ZINC2508689
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