Vitas-M small molecule compound
2-[(1,3-benzodioxol-5-ylmethyl)amino]-3-{(Z)-[4-oxo-3-(propan-2-yl)-2-thioxo-1,3-thiazolidin-5-ylidene]methyl}-4H-pyrido[1,2-a]pyrimidin-4-one
Catalog ID
STK819474
SMILES CC(N1C(=S)S/C(=C\c2c(NCc3ccc4c(c3)OCO4)nc3n(c2=O)cccc3)/C1=O)C
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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 C23H20N4O4S2 MW 480.57 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H20N4O4S2/c1-13(2)27-22(29)18(33-23(27)32)10-15-20(25-19-5-3-4-8-26(19)21(15)28)24-11-14-6-7-16-17(9-14)31-12-30-16/h3-10,13,24H,11-12H2,1-2H3/b18-10-InChIKey
COFBYRCRLIUITA-ZDLGFXPLSA-NSynonyms
(5Z)5((2(13benzodioxol5ylmethylamino)4oxopyrido(12a)pyrimidin3yl)methylidene)3propan2yl2sulfanylidene13thiazolidin4one
2((13benzodioxol5ylmethyl)amino)3((Z)(4oxo3(propan2yl)2thioxo13thiazolidin5ylidene)methyl)4Hpyrido(12a)pyrimidin4one
CC(C)N1C(=O)C(=CC2=C(N=C3C=CC=CN3C2=O)NCC4=CC5=C(C=C4)OCO5)SC1=S
CC(N1C(=S)SC(=Cc2c(NCc3ccc4c(c3)OCO4)nc3n(c2=O)cccc3)C1=O)C
InChI=1SC23H20N4O4S2c113(2)2722(29)18(3323(27)32)101520(2519534826(19)21(15)28)241114671617(914)31123016h3101324H1112H212H3b1810
MFCD03212789
ZINC000016741233
ZINC16741233
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