Vitas-M small molecule compound
ethyl [3-oxo-1-(4-oxo-3-{(Z)-[4-oxo-3-(tetrahydrofuran-2-ylmethyl)-2-thioxo-1,3-thiazolidin-5-ylidene]methyl}-4H-pyrido[1,2-a]pyrimidin-2-yl)piperazin-2-yl]acetate
Catalog ID
STK798907
SMILES CCOC(=O)CC1C(=O)NCCN1c1nc2ccccn2c(=O)c1/C=C/1\SC(=S)N(C1=O)CC1CCCO1
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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 C25H27N5O6S2 MW 557.65 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H27N5O6S2/c1-2-35-20(31)13-17-22(32)26-8-10-28(17)21-16(23(33)29-9-4-3-7-19(29)27-21)12-18-24(34)30(25(37)38-18)14-15-6-5-11-36-15/h3-4,7,9,12,15,17H,2,5-6,8,10-11,13-14H2,1H3,(H,26,32)/b18-12-InChIKey
MIOIZAHCTUCLNA-PDGQHHTCSA-NSynonyms
CCOC(=O)CC1C(=O)NCCN1c1nc2ccccn2c(=O)c1C=C1SC(=S)N(C1=O)CC1CCCO1
CCOC(=O)CC1C(=O)NCCN1C2=C(C(=O)N3C=CC=CC3=N2)C=C4C(=O)N(C(=S)S4)CC5CCCO5
ethyl(3oxo1(4oxo3((Z)(4oxo3(tetrahydrofuran2ylmethyl)2thioxo13thiazolidin5ylidene)methyl)4Hpyrido(12a)pyrimidin2yl)piperazin2yl)acetate
ETHYL2(3OXO1(4OXO3((Z)(4OXO3(OXOLAN2YLMETHYL)2SULFANYLIDENE13THIAZOLIDIN5YLIDENE)METHYL)PYRIDO(12A)PYRIMIDIN2YL)PIPERAZIN2YL)ACETATE
InChI=1SC25H27N5O6S2c123520(31)131722(32)2681028(17)2116(23(33)29943719(29)2721)121824(34)30(25(37)3818)141565113615h3479121517H256810111314H21H3(H2632)b1812
MFCD03462133
ZINC000097946198
ZINC000245227438
Check stock
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Check stock on Vitas-MAvailable files
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