Vitas-M small molecule compound
3-{(Z)-[3-(2-methoxyethyl)-4-oxo-2-thioxo-1,3-thiazolidin-5-ylidene]methyl}-2-(3-methylpiperidin-1-yl)-4H-pyrido[1,2-a]pyrimidin-4-one
Catalog ID
STK798342
SMILES COCCN1C(=S)S/C(=C\c2c(nc3n(c2=O)cccc3)N2CCCC(C2)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 C21H24N4O3S2 MW 444.58 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H24N4O3S2/c1-14-6-5-8-23(13-14)18-15(19(26)24-9-4-3-7-17(24)22-18)12-16-20(27)25(10-11-28-2)21(29)30-16/h3-4,7,9,12,14H,5-6,8,10-11,13H2,1-2H3/b16-12-InChIKey
UFOYOMRYYQWHCZ-VBKFSLOCSA-NSynonyms
(5Z)3(2METHOXYETHYL)5((2(3METHYLPIPERIDIN1YL)4OXOPYRIDO(12A)PYRIMIDIN3YL)METHYLIDENE)2SULFANYLIDENE13THIAZOLIDIN4ONE
3((Z)(3(2methoxyethyl)4oxo2thioxo13thiazolidin5ylidene)methyl)2(3methylpiperidin1yl)4Hpyrido(12a)pyrimidin4one
CC1CCCN(C1)C2=C(C(=O)N3C=CC=CC3=N2)C=C4C(=O)N(C(=S)S4)CCOC
COCCN1C(=S)SC(=Cc2c(nc3n(c2=O)cccc3)N2CCCC(C2)C)C1=O
InChI=1SC21H24N4O3S2c11465823(1314)1815(19(26)24943717(24)2218)121620(27)25(1011282)21(29)3016h34791214H568101113H212H3b1612
MFCD03461935
ZINC000002665875
ZINC000016700252
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