Vitas-M small molecule compound
2-(butylamino)-3-{(Z)-[3-(4-fluorobenzyl)-4-oxo-2-thioxo-1,3-thiazolidin-5-ylidene]methyl}-4H-pyrido[1,2-a]pyrimidin-4-one
Catalog ID
STK815502
SMILES CCCCNc1nc2ccccn2c(=O)c1/C=C/1\SC(=S)N(C1=O)Cc1ccc(cc1)F
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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 C23H21FN4O2S2 MW 468.58 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H21FN4O2S2/c1-2-3-11-25-20-17(21(29)27-12-5-4-6-19(27)26-20)13-18-22(30)28(23(31)32-18)14-15-7-9-16(24)10-8-15/h4-10,12-13,25H,2-3,11,14H2,1H3/b18-13-InChIKey
SFWUDNLMZXWNKQ-AQTBWJFISA-NSynonyms
(5Z)5((2(BUTYLAMINO)4OXOPYRIDO(12A)PYRIMIDIN3YL)METHYLIDENE)3((4FLUOROPHENYL)METHYL)2SULFANYLIDENE13THIAZOLIDIN4ONE
2(butylamino)3((Z)(3(4fluorobenzyl)4oxo2thioxo13thiazolidin5ylidene)methyl)4Hpyrido(12a)pyrimidin4one
CCCCNC1=C(C(=O)N2C=CC=CC2=N1)C=C3C(=O)N(C(=S)S3)CC4=CC=C(C=C4)F
CCCCNc1nc2ccccn2c(=O)c1C=C1SC(=S)N(C1=O)Cc1ccc(cc1)F
InChI=1SC23H21FN4O2S2c12311252017(21(29)271254619(27)2620)131822(30)28(23(31)3218)14157916(24)10815h410121325H231114H21H3b1813
MFCD04442687
ZINC000016732613
ZINC16732613
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